Ethyl 7-chloro-5-(2-fluorophenyl)-2,3-dihydro-1-((methylamino)carbonyl)-2-oxo-1H-1,4-benzodiazepine-3-carboxylate
Basic information
- CAS
65400-85-3- Standard SMILES
CCOC(=O)C1N=C(c2ccccc2F)c2cc(Cl)ccc2N(C(=O)NC)C1=O- InChIKey
PUJLIQLPZOZCOP-UHFFFAOYSA-N- Molecular formula
- C20H17ClFN3O4
- Average molar mass
- 417.8 g/mol
- Monoisotopic mass
- 417.0891619
Names & identifiers
- Preferred name
- Ethyl 7-chloro-5-(2-fluorophenyl)-2,3-dihydro-1-((methylamino)carbonyl)-2-oxo-1H-1,4-benzodiazepine-3-carboxylate
- IUPAC
- ethyl 7-chloro-5-(2-fluorophenyl)-1-(methylcarbamoyl)-2-oxo-3H-1,4-benzodiazepine-3-carboxylate
- English name
- Ethyl
- Molecular formula
- C20H17ClFN3O4
- Molecular weight
- 417.82
Names & synonyms
Ethyl carfluzepateCarfluzepate d'ethyleCarfluzepato de etilo65400-85-3Ethylis carfluzepas36M73UIK01RefChem:1085007Ethyl 7-chloro-5-(2-fluorophenyl)-2,3-dihydro-1-((methylamino)carbonyl)-2-oxo-1H-1,4-benzodiazepine-3-carboxylateEthyl carfluzepate [INN]Ethyl 7-chloro-5-(o-fluorophenyl)-2,3-dihydro-1-(methylcarbamoyl)-2-oxo-1H-1,4-benzodiazepine-3-carboxylate1H-1,4-Benzodiazepine-3-carboxylic acid,7-chloro-5-(2-fluorophenyl)-2,3-dihydro-1-[(methylamino)carbonyl]-2-oxo-, ethyl esterEthylis carfluzepas [INN-Latin]
Show more names
7-Chloro-5-(2-fluorophenyl)-2,3-dihydro-1-(methylcarbamoyl)-2-oxo-1H-1,4-benzodiazepine-3-carboxylic acid ethyl ester7-Chloro-5-(2-fluorophenyl)-2,3-dihydro-1-[(methylamino)carbonyl]-2-oxo-1H-1,4-benzodiazepine-3-carboxylic acid ethyl ester1H-1,4-Benzodiazepine-3-carboxylic acid, 7-chloro-5-(2-fluorophenyl)-2,3-dihydro-1-[(methylamino)carbonyl]-2-oxo-, ethyl ester
Carfluzepate d'ethyle [INN-French]Carfluzepato de etilo [INN-Spanish]CM 7120UNII-36M73UIK01ethyl 7-chloro-5-(2-fluorophenyl)-1-(methylcarbamoyl)-2-oxo-2,3-dihydro-1h-1,4-benzodiazepine-3-carboxylateorb2815516SCHEMBL1003754CHEMBL2106564
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 88.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 689
Physicochemical properties
- FDA UNII
- 36 M73UIK01 · 36M73UIK01
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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