3-Aminobenzamide

Modify Date: 2026-07-01 16:59:07

3-Aminobenzamide structure	Common Name	3-Aminobenzamide
	CAS Number	3544-24-9	Molecular Weight	136.151
	Density	1.2±0.1 g/cm3	Boiling Point	329.6±25.0 °C at 760 mmHg
	Molecular Formula	C₇H₈N₂O	Melting Point	115-116 °C(lit.)
	MSDS	Chinese USA	Flash Point	153.2±23.2 °C
	Symbol	GHS07	Signal Word	Warning

Use of 3-Aminobenzamide

3-Aminobenzamide is a potent inhibitor of PARP with IC50 of appr 50 nM in CHO cells, and acts as a mediator of oxidant-induced myocyte dysfunction during reperfusion.

This table lists Chinese names, IUPAC names and various aliases of this chemical substance.

Name	3-aminobenzamide
Synonym	More Synonyms

This table contains bioactivity, target information and biological‑assay experimental data of this compound.

Description	3-Aminobenzamide is a potent inhibitor of PARP with IC50 of appr 50 nM in CHO cells, and acts as a mediator of oxidant-induced myocyte dysfunction during reperfusion.
Related Catalog	Research Areas >> Cancer
Target	PARP:50 nM (IC50)
In Vitro	3-Aminobenzamide (>1 μM) causes more than 95% inhibition of PARP activity without significant cellular toxicity. INO-1001 significantly sensitizes CHO cells by blocking most of the DNA repair occurring between radiation fractions[1]. 3-Aminobenzamide significantly improves endothelial function by enhancing the acetylcholine-induced, endothelium-dependent, nitric oxide mediated vasorelaxation after exposure with 400 μM H2O2[2].
In Vivo	In a db/db (Leprdb/db) mouse model, 3-Aminobenzamide ameliorates diabetes-induced albumin excretion and mesangial expansion, and also decreases diabetes-induced podocyte depletion[3]. 3-Aminobenzamide (1.6 mg/kg via intracerebral injection) prevents NAD+ depletion and improves water maze performance after controlled cortical impact (CCI) in mice[4].
Kinase Assay	PARP activity is measured with a PARP Activity Assay Kit. This method measures relative PARP activity by determining the level of incorporation of 3H-NAD into trichloroacetic acid (TCA) precipitable material in the presence of sheared genomic DNA, which activates PARP. The reaction mixture is added directly to washed cultures in 12-well culture plates and the reaction is allowed to proceed for 60 minutes at 37°C before the cells are removed mechanically, transferred to a microcentrifuge tube, and precipitated with ice-cold 5% TCA.
Animal Admin	Male db/db (Leprdb/db) mice, together with nondiabetic control db/m mice on C57BLKs/J background, are used. INO-1001 and PJ-34 treatment are initiated at 5 weeks of age. In sterile water that is sweetened with NutraSweet, 4.8 g/L 3-Aminobenzamide and 2.4 g/L PJ-34 is dissolved. Control animals receive sweetened water only. The average inhibitor consumption is 60 mg/kg 3-Aminobenzamide and 30 mg/kg PJ-34.
References	[1]. Brock WA, et al. Radiosensitization of human and rodent cell lines by INO-1001, a novel inhibitor of poly(ADP-ribose) polymerase. Cancer Lett. 2004 Mar 18;205(2):155-60. [2]. Radovits T, et al. Poly(ADP-ribose) polymerase inhibition improves endothelial dysfunction induced by reactive oxidant hydrogen peroxide in vitro. Eur J Pharmacol. 2007 Jun 14;564(1-3):158-66. [3]. Szabo C, et al. Poly(ADP-ribose) polymerase inhibitors ameliorate nephropathy of type 2 diabetic Leprdb/db mice. Diabetes. 2006 Nov;55(11):3004-12. [4]. Clark RS, et al. Local administration of the poly(ADP-ribose) polymerase inhibitor INO-1001 prevents NAD+ depletion and improves water maze performance after traumatic brain injury in mice. J Neurotrauma. 2007 Aug;24(8):1399-405.

This table shows physicochemical parameters including melting point, boiling point, density, solubility and optical rotation. Missing data is marked as N/A.

Density	1.2±0.1 g/cm3
Boiling Point	329.6±25.0 °C at 760 mmHg
Melting Point	115-116 °C(lit.)
Molecular Formula	C₇H₈N₂O
Molecular Weight	136.151
Flash Point	153.2±23.2 °C
Exact Mass	136.063660
PSA	69.11000
LogP	0.33
Vapour Pressure	0.0±0.7 mmHg at 25°C
Index of Refraction	1.633
InChIKey	GSCPDZHWVNUUFI-UHFFFAOYSA-N
SMILES	NC(=O)c1cccc(N)c1
Water Solubility	ethanol: 50 mg/mL, clear, faintly yellow

This table provides MSDS information including hazard classification, first‑aid, fire‑fighting, spill handling, operation and storage instructions.

3-Aminobenzamide MSDS(Chinese)

This table summarizes toxicological test data, acute & chronic toxicity and ecological hazard parameters for this chemical.

CHEMICAL IDENTIFICATION

RTECS NUMBER :: CU8992000

CHEMICAL NAME :: Benzamide, m-amino-

CAS REGISTRY NUMBER :: 3544-24-9

BEILSTEIN REFERENCE NO. :: 2802373

LAST UPDATED :: 199612

DATA ITEMS CITED :: 12

MOLECULAR FORMULA :: C7-H8-N2-O

MOLECULAR WEIGHT :: 136.17

WISWESSER LINE NOTATION :: ZVR CZ

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Oral

SPECIES OBSERVED :: Bird - wild bird species

DOSE/DURATION :: 1 gm/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

MUTATION DATA

TYPE OF TEST :: Sister chromatid exchange

TEST SYSTEM :: Mammal - species unspecified Fibroblast

DOSE/DURATION :: 1 mmol/L

REFERENCE :: MUREAV Mutation Research. (Elsevier Science Pub. B.V., POB 211, 1000 AE Amsterdam, Netherlands) V.1- 1964- Volume(issue)/page/year: 254,13,1991

This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.

Symbol	GHS07
Signal Word	Warning
Hazard Statements	H302-H315-H319-H335
Precautionary Statements	P280-P301 + P312 + P330-P304 + P340 + P312-P305 + P351 + P338-P337 + P313
Personal Protective Equipment	dust mask type N95 (US);Eyeshields;Gloves
Hazard Codes	Xi:Irritant;
Risk Phrases	R36/37/38
Safety Phrases	S26-S36-S37/39
RIDADR	NONH for all modes of transport
WGK Germany	3
RTECS	CU8992000
HS Code	2924299090

This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.

3-NITROBENZAMIDE

CAS#:645-09-0

~94%

3-Aminobenzamide

CAS#:3544-24-9

Learn More

Literature: Rahaim Jr., Ronald J.; Maleczka Jr., Robert E. Synthesis, 2006 , # 19 p. 3316 - 3340

3-Aminobenzonitrile

CAS#:2237-30-1

~99%

3-Aminobenzamide

CAS#:3544-24-9

Learn More

Literature: Brinchi, Lucia; Chiavini, Lisa; Goracci, Laura; Di Profio, Pietro; Germani, Raimondo Letters in Organic Chemistry, 2009 , vol. 6, # 2 p. 175 - 179

3-Formylaniline

CAS#:1709-44-0

~91%

3-Aminobenzamide

CAS#:3544-24-9

Learn More

Literature: Sharghi, Hashem; Sarvari, Mona Hosseini Tetrahedron, 2002 , vol. 58, # 52 p. 10323 - 10328

3-Aminobenzoic acid

CAS#:99-05-8

3-Aminobenzamide

CAS#:3544-24-9

Learn More

Literature: Bulletin of the Korean Chemical Society, , vol. 32, # 12 p. 4444 - 4446

Benzamide,4-chl...

CAS#:16588-06-0

3-Aminobenzamide

CAS#:3544-24-9

Learn More

Literature: Journal of the American Pharmaceutical Association (1912-1977), , vol. 48, p. 201

This table lists upstream starting materials and downstream derivative products related to this chemical.

Precursor 5
CAS#:645-09-0 3-NITROBENZAMIDE CAS#:2237-30-1 3-Aminobenzonitrile CAS#:1709-44-0 3-Formylaniline CAS#:99-05-8 3-Aminobenzoic acid
CAS#:16588-06-0 Benzamide,4-chl...
DownStream 10
CAS#:4403-70-7 3-(Aminomethyl)... CAS#:99-03-6 3-Aminoacetophenone CAS#:147291-66-5 tert-Butyl-(3-a... CAS#:178984-42-4 4-chloroquinoli...
CAS#:2237-30-1 3-Aminobenzonitrile CAS#:122-49-6 3-semicarbazido... CAS#:74615-43-3 Benzamide, 3-(c... CAS#:85126-66-5 3-[(2-chloroace...
CAS#:885274-73-7 2-(3-AMINO-PHEN... CAS#:885278-66-0 2-(3-Amino-phen...

This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.

HS Code	2924299090
Summary	2924299090. other cyclic amides (including cyclic carbamates) and their derivatives; salts thereof. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%

This table lists relevant public references with title, journal and publication metadata for this compound.

Protein poly(ADP-ribosyl)ation regulates arabidopsis immune gene expression and defense responses.

PLoS Genet. 11(1) , e1004936, (2015)

Perception of microbe-associated molecular patterns (MAMPs) elicits transcriptional reprogramming in hosts and activates defense to pathogen attacks. The molecular mechanisms underlying plant pattern-...

Chemical genetics reveals a complex functional ground state of neural stem cells.

Nat. Chem. Biol. 3(5) , 268-273, (2007)

The identification of self-renewing and multipotent neural stem cells (NSCs) in the mammalian brain holds promise for the treatment of neurological diseases and has yielded new insight into brain canc...

One-pot enzymatic conversion of carbon dioxide and utilization for improved microbial growth.

Environ. Sci. Technol. 49(7) , 4466-72, (2015)

We developed a process for one-pot CO2 conversion and utilization based on simple conversion of CO2 to bicarbonate at ambient temperature with no energy input, by using the cross-linking-based composi...

This table contains target information, in‑vitro & in‑vivo assay data for this compound.

Name: DRUGMATRIX: Opiate delta1 (OP1, DOP) radioligand binding (ligand: [3H] Naltrindole)
Source: ChEMBL
Target: Delta-type opioid receptor
External Id: CHEMBL1909180

Name: DRUGMATRIX: Nitric Oxide Synthase, Inducible (iNOS) enzyme inhibition (substrate: L-A...
Source: ChEMBL
Target: Nitric oxide synthase, inducible
External Id: CHEMBL1909179

Name: DRUGMATRIX: Opiate mu (OP3, MOP) radioligand binding (ligand: [3H] Diprenorphine)
Source: ChEMBL
Target: Mu-type opioid receptor
External Id: CHEMBL1909182

Name: Inhibition of PARP1
Source: ChEMBL
Target: Poly [ADP-ribose] polymerase 1
External Id: CHEMBL1176193

Name: Inhibition of neurosphere proliferation of mouse neural precursor cells by MTT assay
Source: ChEMBL
Target: N/A
External Id: CHEMBL1266185

Name: Primary qHTS assay for inhibitors of alpha-synuclein gene (SNCA) expression
Source: NCGC
External Id: SNCA-p-activity-luciferase

Name: DRUGMATRIX: Opiate kappa (OP2, KOP) radioligand binding (ligand: [3H] Diprenorphine)
Source: ChEMBL
Target: Kappa-type opioid receptor
External Id: CHEMBL1909181

Name: DRUGMATRIX: Phosphodiesterase PDE3 enzyme inhibition (substrate: [3H]cAMP + cAMP)
Source: ChEMBL
Target: N/A
External Id: CHEMBL1909184

Name: DRUGMATRIX: Phorbol Ester radioligand binding (ligand: [3H] PDBu)
Source: ChEMBL
Target: N/A
External Id: CHEMBL1909183

Name: DRUGMATRIX: Phosphodiesterase PDE5 enzyme inhibition (substrate: [3H]cGMP + cGMP)
Source: ChEMBL
Target: cGMP-specific 3',5'-cyclic phosphodiesterase
External Id: CHEMBL1909186

Total 354, Current Page 1 of 36

This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.

meta-aminobenzoylamine

m-Aminobenzamide

3-Aminobenzimide

Benzamide,m-amino

3-Aminobenzamide

3-Amino-benzamide

MFCD00007989

EINECS 222-586-9

Benzamide,3-amino

INO1001

meta-aminobenzamide

3-NH2-Ph-CO-NH2

5-amino-benzamide

INO-1001

This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.

Q: How is the water solubility of 3-aminobenzamide?

A: Water solubility of 3-aminobenzamide: ethanol: 50 mg/mL, clear, faintly yellow.

Q: What is the English name of 3-aminobenzamide?

A: The English name of 3-aminobenzamide is 3-aminobenzamide.

Q: What is the molecular weight of 3-aminobenzamide?

A: Molecular weight of 3-aminobenzamide is 136.151.

Q: What is the InChIKey of 3-aminobenzamide?

A: InChIKey of 3-aminobenzamide is GSCPDZHWVNUUFI-UHFFFAOYSA-N.

Q: What is the safety information for 3-aminobenzamide?

A: Safety information for 3-aminobenzamide: S26-S36-S37/39.

Q: What is the SMILES notation of 3-aminobenzamide?

A: SMILES notation of 3-aminobenzamide is NC(=O)c1cccc(N)c1.

Q: What is the boiling point of 3-aminobenzamide?

A: Boiling point of 3-aminobenzamide is 329.6±25.0 °C at 760 mmHg.

Q: What is the polar surface area (PSA) of 3-aminobenzamide?

A: Polar surface area (PSA) of 3-aminobenzamide is 69.11000.

Q: What are the upstream materials of 3-aminobenzamide?

A: Related upstream materials(CAS) of 3-aminobenzamide: 645-09-0;2237-30-1;1709-44-0;99-05-8;16588-06-0.

Q: What is the LogP of 3-aminobenzamide?

A: LogP of 3-aminobenzamide is 0.33.

This table lists manufacturers and suppliers of this compound, including vendor names and product supply reference information.

Shanghai Nianxing Industrial Co., Ltd

Dayang Chem (Hangzhou) Co., Ltd.

Henan Tianfu Chemical Co., Ltd.

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Shanghai Nianxing Industrial Co., Ltd
China
Product Name: 3-Aminobenzamide
Price: Check
Purity: 98.0%
Delivery: 10 Day
Contact: Yang
Email: sales@echemcloud.com

Dayang Chem (Hangzhou) Co., Ltd.
China
Product Name: 3-Aminobenzamide
Price: $Inquiry/100g $Inquiry/1kg $Inquiry/100kg $Inquiry/1000kg
Purity: 98.0%
Delivery: Inquiry
Contact: Ms Wang
Email: enquiry@dycnchem.com

Henan Tianfu Chemical Co., Ltd.
China
Product Name: 3-aminobenzamide
Price: $Inquiry/1kg $Inquiry/25kg $Inquiry/1000kg $Inquiry/10ton
Purity: 99.0%
Delivery: Inquiry
Contact: Anson
Email: info@tianfuchem.com

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Price: $66/10mM*1mLinDMSO

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3-Aminobenzamide

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