1H-1,5-Benzodiazepine-2,4(3H,5H)-dione, 7-chloro-1-(cyclohexylcarbonyl)-5-phenyl-
Basic information
- CAS
24826-55-9- Standard SMILES
O=C1CC(=O)N(c2ccccc2)c2cc(Cl)ccc2N1C(=O)C1CCCCC1- InChIKey
JYJYCOCMVSVVHG-UHFFFAOYSA-N- Molecular formula
- C22H21ClN2O3
- Average molar mass
- 396.9 g/mol
- Monoisotopic mass
- 396.1240702
Names & identifiers
- Preferred name
- 1H-1,5-Benzodiazepine-2,4(3H,5H)-dione, 7-chloro-1-(cyclohexylcarbonyl)-5-phenyl-
- IUPAC
- 7-chloro-1-(cyclohexanecarbonyl)-5-phenyl-1,5-benzodiazepine-2,4-dione
Names & synonyms
7-Chloro-1-(cyclohexylcarbonyl)-5-phenyl-1H-1,5-benzodiazepine-2,4(3H,5H)-dione24826-55-91H-1,5-Benzodiazepine-2,4(3H,5H)-dione, 7-chloro-1-(cyclohexylcarbonyl)-5-phenyl-DTXSID60179529RefChem:237200DTXCID701020207-Chloro-1-(cyclohexanecarbonyl)-5-phenyl-1H-1,5-benzodiazepine-2,4(3H,5H)-dione
Database identifiers
- CAS
24826-55-9- PubChem CID
- 212745
- DTXSID
DTXSID60179529
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 57.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 613
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Compound notes
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