3-Amino-5-(cyclopropylmethyl)-2-phenyl-2,3-dihydro-1,5-benzoxazepin-4-one
Basic information
- Standard SMILES
NC1C(=O)N(CC2CC2)c2ccccc2OC1c1ccccc1- InChIKey
BZJFUCYEHXUOHJ-UHFFFAOYSA-N- Molecular formula
- C19H20N2O2
- Average molar mass
- 308.4 g/mol
Names & identifiers
- Preferred name
- 3-Amino-5-(cyclopropylmethyl)-2-phenyl-2,3-dihydro-1,5-benzoxazepin-4-one
- IUPAC
- 3-amino-5-(cyclopropylmethyl)-2-phenyl-2,3-dihydro-1,5-benzoxazepin-4-one
Names & synonyms
SCHEMBL3406444
Database identifiers
- PubChem CID
- 68630407
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 55.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 431
Related reactions
2 records
Compound notes
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