1H-Pyrido[4,3-b]indole,2,3,4,5-tetrahydro-2-methyl

Modify Date: 2025-08-27 20:28:05

1H-Pyrido[4,3-b]indole,2,3,4,5-tetrahydro-2-methyl structure	Common Name	1H-Pyrido[4,3-b]indole,2,3,4,5-tetrahydro-2-methyl
	CAS Number	5094-12-2	Molecular Weight	186.25300
	Density	1.165g/cm3	Boiling Point	326.4ºC at 760 mmHg
	Molecular Formula	C₁₂H₁₄N₂	Melting Point	172 °C
	MSDS	N/A	Flash Point	151.2ºC

Name	2-Methyl-2,3,4,5-tetrahydro-1H-pyrido[4,3-b]indole
Synonym	More Synonyms

Density	1.165g/cm3
Boiling Point	326.4ºC at 760 mmHg
Melting Point	172 °C
Molecular Formula	C₁₂H₁₄N₂
Molecular Weight	186.25300
Flash Point	151.2ºC
Exact Mass	186.11600
PSA	19.03000
LogP	2.09370
Index of Refraction	1.66
InChIKey	FYHWPFXPFFPQRT-UHFFFAOYSA-N
SMILES	CN1CCc2[nH]c3ccccc3c2C1
Storage condition	2-8°C

CHEMICAL IDENTIFICATION

RTECS NUMBER :: UV0830000

CHEMICAL NAME :: 1H-Pyrido(4,3-b)indole, 2,3,4,5-tetrahydro-2-methyl-

CAS REGISTRY NUMBER :: 5094-12-2

BEILSTEIN REFERENCE NO. :: 0152265

LAST UPDATED :: 199612

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C12-H14-N2

MOLECULAR WEIGHT :: 186.28

WISWESSER LINE NOTATION :: T B656 DN HMT&&J D1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

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

ROUTE OF EXPOSURE :: Oral

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 430 mg/kg

TOXIC EFFECTS :: Behavioral - analgesia

REFERENCE :: JMCMAR Journal of Medicinal Chemistry. (American Chemical Soc., Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC 20037) V.6- 1963- Volume(issue)/page/year: 9,436,1966

Hazard Codes	Xi
HS Code	2933990090

Precursor 10
CAS#:1445-73-4 N-Methyl-4-pipe... CAS#:100-63-0 Phenylhydrazine CAS#:59-88-1 Phenylhydrazine... CAS#:34737-83-2 1-Methyl-4-pipe...
CAS#:33547-84-1 5-bromo-2-methy... CAS#:1296771-08-8 2-methyl-5H-pyr... CAS#:1346446-46-5 (3-chlorophenyl... CAS#:177202-83-4 2-(PYRIDIN-3-YL...
CAS#:1296770-81-4 1-methyl-3-(2-a... CAS#:856849-78-0 3-(2-azidopheny...
DownStream 3
CAS#:1239262-52-2 Tubastatin A CAS#:75397-73-8 3-p-anisyl-4,6-... CAS#:64157-99-9 2-methoxy-1'-me...

HS Code	2933990090
Summary	2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

Name: Solubility of the compound at >= 50 uM
Source: ChEMBL
Target: N/A
External Id: CHEMBL4825148

Name: Inhibition of recombinant equine BChE by Ellman's method
Source: ChEMBL
Target: Cholinesterase
External Id: CHEMBL4825145

Name: Inhibition of human GluN1-1a/NR2A receptor expressed in transgenic mouse fibroblast c...
Source: ChEMBL
Target: Glutamate receptor ionotropic, NMDA 2A
External Id: CHEMBL4825139

Name: Inhibition of recombinant human AChE expressed in HEK293 cells at 50 uM by Ellman's m...
Source: ChEMBL
Target: Acetylcholinesterase
External Id: CHEMBL4825143

Name: Cell-based high throughput primary assay to identify activators of GPR151
Source: The Scripps Research Institute Molecular Screening Center
Target: RecName: Full=G-protein coupled receptor 151; AltName: Full=G-protein coupled receptor PGR7; AltName: Full=GPCR-2037; AltName: Full=Galanin receptor 4; AltName: Full=Galanin-receptor-like protein; Short=GalRL
External Id: GPR151_PHUNTER_AG_LUMI_1536_1X%ACT

Name: AlphaScreen-based biochemical high throughput primary assay to identify activators of...
Source: The Scripps Research Institute Molecular Screening Center
Target: N/A
External Id: FBW7_ACT_ALPHA_1536_1X%ACT PRUN

Name: AlphaScreen-based biochemical high throughput primary assay to identify inhibitors of...
Source: The Scripps Research Institute Molecular Screening Center
External Id: MITF_INH_Alpha_1536_1X%INH PRUN

Name: Inhibition of human GluN1-1a/NR2B receptor expressed in transgenic mouse fibroblast c...
Source: ChEMBL
Target: Neuronal acetylcholine receptor subunit alpha-6
External Id: CHEMBL4825141

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2-methyl-1,3,4,5-tetrahydropyrido[4,3-b]indole

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Product Name: 1H-Pyrido[4,3-b]indole,2,3,4,5-tetrahydro-2-methyl-
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Product Name: 1H-Pyrido[4,3-b]indole,2,3,4,5-tetrahydro-2-methyl
Price: ￥568.0/250mg ￥188.0/50mg
Purity: 98.0%
Delivery: 2 Day
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1H-Pyrido[4,3-b]indole,2,3,4,5-tetrahydro-2-methyl

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Chemical & Physical Properties

Toxicological Information

CHEMICAL IDENTIFICATION

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

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Precursor & DownStream

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Bioassay

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