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

HCID 136353533

Basic information

Standard SMILES
CN(C)C=C1N=C(c2ccccc2Cl)c2cc(Cl)ccc2NC1=O
InChIKey
TVCAWAUYNBFJEE-UHFFFAOYSA-N
Molecular formula
C18H15Cl2N3O
Average molar mass
360.2 g/mol

Names & identifiers

Preferred name
7-Chloro-5-(2'-chloro-phenyl)-1,3-dihydro-3-(dimethylaminomethylene)-2H-1,4-benzodiazepin-2-one
IUPAC
7-chloro-5-(2-chlorophenyl)-3-(dimethylaminomethylidene)-1H-1,4-benzodiazepin-2-one

Names & synonyms

SCHEMBL11769606TVCAWAUYNBFJEE-UHFFFAOYSA-N7-chloro-5-(2'-chloro-phenyl)-1,3-dihydro-3-(dimethylamino-methylene)-2H-1,4-benzodiazepin-2-one7-Chloro-5-(2'-chloro-phenyl)-1,3-dihydro-3-(dimethylaminomethylene)-2H-1,4-benzodiazepin-2-one

Database identifiers

PubChem CID
136353533

Properties

Computed structural properties

XLogP
3.6
Topological polar surface area
44.7 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
2
Heavy atoms
24

Related reactions

4 records

Compound notes

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