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Basic information
- Standard SMILES
O=C1COCCC(c2ccccc2)N1Cc1ccccc1- InChIKey
UXGJOUNZIDZUBZ-UHFFFAOYSA-N- Molecular formula
- C18H19NO2
- Average molar mass
- 281.3 g/mol
- Monoisotopic mass
- 281.14157885
Names & identifiers
- Preferred name
- 4-Benzyl-5-phenyl-[1,4]oxazepan-3-one
- IUPAC
- 4-benzyl-5-phenyl-1,4-oxazepan-3-one
Names & synonyms
SCHEMBL2118646UXGJOUNZIDZUBZ-UHFFFAOYSA-N4-benzyl-5-phenyl-[1,4]oxazepan-3-one
Database identifiers
- PubChem CID
- 67282920
Properties
Computed structural propertiesFilling in
- XLogP
- 2.8
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 332
Related reactions
2 records
Compound notes
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