7-Chloro-5-(2-fluoro-phenyl)-1,3-dihydro-2H-1,4-benzodiazepin-2-one

Base Information

Chemical Name:7-Chloro-5-(2-fluoro-phenyl)-1,3-dihydro-2H-1,4-benzodiazepin-2-one
CAS No.:2886-65-9
Molecular Formula:C15H10ClFN2O
Molecular Weight:288.709
Hs Code.:2933997500
European Community (EC) Number:220-748-3
UNII:X9U41NXR6M
DSSTox Substance ID:DTXSID30183057
Nikkaji Number:J13.722G
Wikidata:Q27293739
ChEMBL ID:CHEMBL974
Mol file:2886-65-9.mol

7-Chloro-5-(2-fluoro-phenyl)-1,3-dihydro-2H-1,4-benzodiazepin-2-one

Synonyms:2H-1,4-Benzodiazepin-2-one,7-chloro-5-(o-fluorophenyl)-1,3-dihydro- (7CI,8CI);7-Chloro-1,3-dihydro-5-(2'-fluorophenyl)-2H-1,4-benzodiazapin-2-one;7-Chloro-5-(2'-fluorophenyl)-1,3-dihydro-2H-1,4-benzodiazepin-2-one;7-Chloro-5-(o-fluorophenyl)-1,3-dihydro-1,4-benzodiazepin-2-one;7-Chloro-5-(o-fluorophenyl)-1,3-dihydro-2H-1,4-benzodiazepine-2-one;CM 7116;Descarbethoxyloflazepate;N-1-Desalkylflurazepam;N-Desalkyl-2-oxoquazepam;N-Desalkylflutoprazepam;Norfludiazepam;Norflurazepam;Norflutoprazepam;Ro 5-3367;Sch 17514;

This product is a nationally controlled contraband, and the Lookchem platform doesn't provide relevant sales information.

Chemical Property of 7-Chloro-5-(2-fluoro-phenyl)-1,3-dihydro-2H-1,4-benzodiazepin-2-one

Chemical Property:

Appearance/Colour:Light yellow solid
Vapor Pressure:1.97E-08mmHg at 25°C
Melting Point:204-206 °C
Refractive Index:1.647
Boiling Point:454 °C at 760 mmHg
PKA:11.55±0.70(Predicted)
Flash Point:228.4 °C
PSA：41.46000
Density:1.39 g/cm³
LogP:2.84220
Storage Temp.:-20°C Freezer
XLogP3:2.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:288.0465688
Heavy Atom Count:20
Complexity:415

Purity/Quality:

Safty Information:

Pictogram(s): F,T
Hazard Codes:F,T
Statements: 11-23/24/25-39/23/24/25
Safety Statements: 22-24/25-45-36/37-16-7

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1C(=O)NC2=C(C=C(C=C2)Cl)C(=N1)C3=CC=CC=C3F
Description Desalkylflurazepam (Item No. 18484) is an analytical reference material that is structurally categorized as a benzodiazepine. It is an active metabolite of several benzodiazepines, including flurazepam , flutoprazepam, fludiazepam, midazolam, and quazepam. Desalkylflurazepam inhibits L-type voltage-gated calcium channels (Cav; IC50s = 55 and 37 μM for Cav1.2 and 1.3, respectively) by positively modulating GABAA receptors. It can be detected in urine, serum, and meconium by LC-MS/MS. This product is intended for research and forensic applications.
Uses The major human metabolite of flurazepam. This is a controlled drug precursor therefore a liscence may be required for purchase

Technology Process of 7-Chloro-5-(2-fluoro-phenyl)-1,3-dihydro-2H-1,4-benzodiazepin-2-one

There total 16 articles about 7-Chloro-5-(2-fluoro-phenyl)-1,3-dihydro-2H-1,4-benzodiazepin-2-one which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 80.0%

: 4530-20-5
BOC-glycine

: 784-38-3
2-amino-5-chloro-2'-fluorobenzophenone

: 2886-65-9
7-chloro-5-(2-fluorophenyl)-1,3-dihydro-1,4-benzodiazepin-2(2H)-one

Guidance literature:: BOC-glycine; 2-amino-5-chloro-2'-fluorobenzophenone; With dicyclohexyl-carbodiimide; In toluene; at 150 ℃; for 0.5h; Microwave irradiation;

With trifluoroacetic acid; In toluene; at 150 ℃; for 0.333333h; Microwave irradiation;
DOI:10.1039/c1nj20551j