1H-1,4-Benzodiazepine-2,5-dione, 7-chloro-4-cyclopentyl-3,4-dihydro-
Basic information
- CAS
167689-96-5- Standard SMILES
O=C1CN(C2CCCC2)C(=O)c2cc(Cl)ccc2N1- InChIKey
LQOYBXDSUXSVAO-UHFFFAOYSA-N- Molecular formula
- C14H15ClN2O2
- Average molar mass
- 278.73 g/mol
- Monoisotopic mass
- 278.0822054
Names & identifiers
- Preferred name
- 1H-1,4-Benzodiazepine-2,5-dione, 7-chloro-4-cyclopentyl-3,4-dihydro-
- IUPAC
- 7-chloro-4-cyclopentyl-1,3-dihydro-1,4-benzodiazepine-2,5-dione
Names & synonyms
1H-1,4-Benzodiazepine-2,5-dione, 7-chloro-4-cyclopentyl-3,4-dihydro-167689-96-57-Chloro-4-cyclopentyl-3,4-dihydro-1H-1,4-benzodiazepine-2,5-dioneDTXSID80168354
Database identifiers
- CAS
167689-96-5- PubChem CID
- 178109
- DTXSID
DTXSID80168354- Nikkaji
- J816.020A
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 49.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 382
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Compound notes
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