7,10-Dimethyl-2-hydroxy-dibenz(b,f)(1,4)oxazepin-11-(10H)-one
Basic information
- CAS
140413-01-0- Standard SMILES
Cc1ccc2c(c1)Oc1ccc(O)cc1C(=O)N2C- InChIKey
DAQWPIAFUKEARE-UHFFFAOYSA-N- Molecular formula
- C15H13NO3
- Average molar mass
- 255.27 g/mol
- Monoisotopic mass
- 255.08954328
Names & identifiers
- Preferred name
- 7,10-Dimethyl-2-hydroxy-dibenz(b,f)(1,4)oxazepin-11-(10H)-one
- IUPAC
- 8-hydroxy-2,5-dimethylbenzo[b][1,4]benzoxazepin-6-one
Names & synonyms
2OH-7,10diMe-DBOA-11one140413-01-07,10-Dimethyl-2-hydroxy-dibenz(b,f)(1,4)oxazepin-11-(10H)-one7,10-Dimethyl-2-hydroxy-dibenz[b,f][1,4]oxazepin-11-(10H)-oneDibenzoxazepinone 39CHEMBL55610BDBM1989DTXSID701613548-hydroxy-2,5-dimethyl-benzo[b][1,4]benzoxazepin-6-one2-Hydroxy-7,10-dimethyldibenzo[b,f][1,4]oxazepin-11(10H)-one13-hydroxy-5,9-dimethyl-2-oxa-9-azatricyclo[9.4.0.0^{3,8}]pentadeca-1(15),3,5,7,11,13-hexaen-10-one
Database identifiers
- CAS
140413-01-0- PubChem CID
- 453945
- DTXSID
DTXSID70161354- ChEMBL
CHEMBL55610- Nikkaji
- J474.960J
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 49.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 359
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…