Basic information
- Standard SMILES
O=C1CC(=O)N(c2ccccc2)C(=O)N1Cc1ccccc1- InChIKey
PBYXTTOSNJVDEJ-UHFFFAOYSA-N- Molecular formula
- C17H14N2O3
- Average molar mass
- 294.3 g/mol
- Monoisotopic mass
- 294.10044231
Names & identifiers
- Preferred name
- 1-Benzyl-3-phenylbarbituric acid
- IUPAC
- 1-benzyl-3-phenyl-1,3-diazinane-2,4,6-trione
Names & synonyms
SCHEMBL26803281-benzyl-3-phenylbarbituric acidPBYXTTOSNJVDEJ-UHFFFAOYSA-N
Database identifiers
- PubChem CID
- 21708751
- Nikkaji
- J3.258.533G
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 57.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 451
Related reactions
2 records
Compound notes
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