1,11,12,12a-Tetrahydrobenzo[f]imidazo[1,5-a]quinolin-3(2h)-one
Basic information
- CAS
18007-11-9- Standard SMILES
O=C1NCC2CCc3c(ccc4ccccc34)N12- InChIKey
UFDOKTYCSHHKDL-UHFFFAOYSA-N- Molecular formula
- C15H14N2O
- Average molar mass
- 238.28 g/mol
- Monoisotopic mass
- 238.11061307
Names & identifiers
- Preferred name
- 1,11,12,12a-Tetrahydrobenzo[f]imidazo[1,5-a]quinolin-3(2h)-one
- IUPAC
- 11,13-diazatetracyclo[8.7.0.02,7.011,15]heptadeca-1(10),2,4,6,8-pentaen-12-one
Names & synonyms
18007-11-91,11,12,12a-tetrahydrobenzo[f]imidazo[1,5-a]quinolin-3(2h)-oneNSC110334DTXSID20296600NSC-110334
Database identifiers
- CAS
18007-11-9- PubChem CID
- 269368
- DTXSID
DTXSID20296600
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 32.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 356
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Compound notes
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