(1)Benzopyrano(2,3-b)(1,5)benzodiazepin-13(6H)-one, 6-benzoyl-
Basic information
- CAS
112058-97-6- Standard SMILES
O=C(c1ccccc1)N1c2ccccc2N=Cc2c1oc1ccccc1c2=O- InChIKey
IVKZRTQGAILYNN-UHFFFAOYSA-N- Molecular formula
- C23H14N2O3
- Average molar mass
- 366.4 g/mol
- Monoisotopic mass
- 366.10044231
Names & identifiers
- Preferred name
- (1)Benzopyrano(2,3-b)(1,5)benzodiazepin-13(6H)-one, 6-benzoyl-
- IUPAC
- 6-benzoylchromeno[2,3-b][1,5]benzodiazepin-13-one
Names & synonyms
(1)Benzopyrano(2,3-b)(1,5)benzodiazepin-13(6H)-one, 6-benzoyl-6-Benzoyl-(1)benzopyrano(2,3-b)(1,5)benzodiazepin-13(6H)-one112058-97-6DTXSID40149846RefChem:203805DTXCID70723376-Benzoyl[1]benzopyrano[2,3-b][1,5]benzodiazepin-13(6H)-one
Database identifiers
- CAS
112058-97-6- PubChem CID
- 3086798
- DTXSID
DTXSID40149846
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 59 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 707
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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