9H-Dibenzo(c,f)imidazo(1,2-a)azepin-9-one
Basic information
- CAS
57960-37-9- Standard SMILES
O=c1c2ccccc2c2nccn2c2ccccc12- InChIKey
AYSFVIFYOXIPOH-UHFFFAOYSA-N- Molecular formula
- C16H10N2O
- Average molar mass
- 246.26 g/mol
- Monoisotopic mass
- 246.07931295
Names & identifiers
- Preferred name
- 9H-Dibenzo(c,f)imidazo(1,2-a)azepin-9-one
- IUPAC
- 2,5-diazatetracyclo[12.4.0.02,6.07,12]octadeca-1(18),3,5,7,9,11,14,16-octaen-13-one
- English name
- 9H-Dibenzo(c,f)imidazo(1,2-a)azepin-9-one
- Molecular formula
- C16H10N2O
- Molecular weight
- 246.2634
Names & synonyms
9H-Dibenzo(c,f)imidazo(1,2-a)azepin-9-one57960-37-98AQ4YKY8BBNSC 363938NSC-3639389H-Dibenzo[c,f]imidazo[1,2-a]azepin-9-oneDTXSID702066789H-DIBENZ(C,F)IMIDAZO(1,2-A)AZEPIN-9-ONE2,5-DIAZATETRACYCLO(12.4.0.02,6.07,12)OCTADECA-1(18),3,5,7,9,11,14,16-OCTAEN-13-ONERefChem:108242DTXCID00129169UNII-8AQ4YKY8BB
Show more names
NSC363938SCHEMBL11459997DS-006134
Database identifiers
- CAS
57960-37-9- PubChem CID
- 339032
- DTXSID
DTXSID70206678- UNII
- 8AQ4YKY8BB
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 34.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 370
Physicochemical properties
- FDA UNII
- 8 AQ4YKY8BB · 8AQ4YKY8BB
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…