7-Chloro-5-(2-fluorophenyl)-1,3-dihydro-3-hydroxy-1-methyl-2H-1,4-benzodiazepin-2-one

Modify Date: 2025-09-27 14:07:05

7-Chloro-5-(2-fluorophenyl)-1,3-dihydro-3-hydroxy-1-methyl-2H-1,4-benzodiazepin-2-one structure	Common Name	7-Chloro-5-(2-fluorophenyl)-1,3-dihydro-3-hydroxy-1-methyl-2H-1,4-benzodiazepin-2-one
	CAS Number	52391-89-6	Molecular Weight	318.73000
	Density	1.4g/cm3	Boiling Point	550.3ºC at 760mmHg
	Molecular Formula	C₁₆H₁₂ClFN₂O₂	Melting Point	N/A
	MSDS	N/A	Flash Point	286.6ºC

Name	7-chloro-5-(2-fluorophenyl)-3-hydroxy-1-methyl-3H-1,4-benzodiazepin-2-one
Synonym	More Synonyms

Density	1.4g/cm3
Boiling Point	550.3ºC at 760mmHg
Molecular Formula	C₁₆H₁₂ClFN₂O₂
Molecular Weight	318.73000
Flash Point	286.6ºC
Exact Mass	318.05700
PSA	52.90000
LogP	2.11190
Index of Refraction	1.641
InChIKey	RMFYWNFETXNTIQ-UHFFFAOYSA-N
SMILES	CN1C(=O)C(O)N=C(c2ccccc2F)c2cc(Cl)ccc21

CHEMICAL IDENTIFICATION

RTECS NUMBER :: DF2370300

CHEMICAL NAME :: 2H-1,4-Benzodiazepin-2-one, 1,3-dihydro-7-chloro-5-(2-fluorophenyl)-3-hydroxy-1-m ethyl-

CAS REGISTRY NUMBER :: 52391-89-6

BEILSTEIN REFERENCE NO. :: 0688457

LAST UPDATED :: 199612

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C16-H12-Cl-F-N2-O2

MOLECULAR WEIGHT :: 318.75

WISWESSER LINE NOTATION :: T67 GNV JN IHJ CG G1 IQ KR BF

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

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

ROUTE OF EXPOSURE :: Intraperitoneal

SPECIES OBSERVED :: Rodent - rat

DOSE/DURATION :: 1400 mg/kg

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

REFERENCE :: PHMGBN Pharmacology: International Journal of Experimental and Clinical Pharmacology. (S. Karger AG, Postfach CH-4009 Basel, Switzerland) V.1- 1968- Volume(issue)/page/year: 12,74,1974

N/A

CAS#:89722-84-9

7-Chloro-5-(2-f...

CAS#:52391-89-6

Literature: Middleton, W. J.; Bingham, E. M.; Smith, D. H. Journal of Fluorine Chemistry, 1983 , vol. 23, p. 557 - 572

7-chloro-5-(2-f...

CAS#:41300-29-2

7-Chloro-5-(2-f...

CAS#:52391-89-6

Literature: Middleton, W. J.; Bingham, E. M.; Smith, D. H. Journal of Fluorine Chemistry, 1983 , vol. 23, p. 557 - 572

Precursor 1
CAS#:41300-29-2 7-chloro-5-(2-f...
DownStream 0

Name: ED50 value was reported as log1/C, which is the concentration required to reduce loco...
Source: ChEMBL
Target: Rattus norvegicus
External Id: CHEMBL797716

Name: Halving of lever pressing in non punished rats, ED50 value reported as log 1/C
Source: ChEMBL
Target: Rattus norvegicus
External Id: CHEMBL797719

Name: Fourfod increase in lever pressing in punished rats, ED50 value reported as log1/C
Source: ChEMBL
Target: Rattus norvegicus
External Id: CHEMBL797717

Name: Partition coefficient (logP)
Source: ChEMBL
Target: N/A
External Id: CHEMBL632465

Total 4, Current Page 1 of 1

FLUTEMAZEPAM

Flutemazepam [INN]

Flutemazepamum [Latin]

EINECS 257-892-1

7-Chloro-1,3-dihydro-1-methyl-3-hydroxy-5-(2-fluorophenyl)-2H-1,4-benzodiazepin-2-one

Sas-646

7-Chloro-5-(2-fluorophenyl)-1,3-dihydro-3-hydroxy-1-methyl-2H-1,4-benzodiazepin-2-one

2H-1,4-Benzodiazepin-2-one,1,3-dihydro-7-chloro-5-(2-fluorophenyl)-3-hydroxy-1-methyl

The content on this webpage is sourced from various professional data sources. If you have any questions or concerns regarding the content, please feel free to contact service1@chemsrc.com.

7-Chloro-5-(2-fluorophenyl)-1,3-dihydro-3-hydroxy-1-methyl-2H-1,4-benzodiazepin-2-one

Names

Chemical & Physical Properties

Toxicological Information

CHEMICAL IDENTIFICATION

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

Synthetic Route

Precursor & DownStream

Bioassay

Synonyms

The content on this webpage is sourced from various professional data sources. If you have any questions or concerns regarding the content, please feel free to contact service1@chemsrc.com.