8-chloro-4-dimethylaminomethylene-3,4-dihydro-1H-benzo[b]azepine-2,5-dione

HCID 66934877

Basic information

Standard SMILES
CN(C)C=C1CC(=O)Nc2cc(Cl)ccc2C1=O
InChIKey
NAMXZEZCNUIYCF-UHFFFAOYSA-N
Molecular formula
C13H13ClN2O2
Average molar mass
264.71 g/mol

Names & identifiers

Preferred name
8-chloro-4-dimethylaminomethylene-3,4-dihydro-1H-benzo[b]azepine-2,5-dione
IUPAC
8-chloro-4-(dimethylaminomethylidene)-1H-1-benzazepine-2,5-dione

Names & synonyms

SCHEMBL1185543NAMXZEZCNUIYCF-UHFFFAOYSA-N8-chloro-4-dimethylaminomethylene-3,4-dihydro-1H-benzo[b]azepine-2,5-dione8-chloro-4-((dimethylamino)methylene)-3,4-dihydro-1H-benzo[b]azepine-2,5-dione8-chloro-4-dimethylaminomethylene-3,4-dihydro-1H-benzo[b]-azepine-2,5-dione

Database identifiers

PubChem CID
66934877

Properties

Computed structural properties

XLogP
1.5
Topological polar surface area
49.4 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
1
Heavy atoms
18

Related reactions

46 records

Compound notes

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