3-(1-hydroxy-3-phenylpropan-2-yl)-1H-quinoxalin-2-one
Basic information
- CAS
7621-98-9- Standard SMILES
O=c1[nH]c2ccccc2nc1C(CO)Cc1ccccc1- InChIKey
BDFCGGXTYPHGJK-UHFFFAOYSA-N- Molecular formula
- C17H16N2O2
- Average molar mass
- 280.32 g/mol
- Monoisotopic mass
- 280.12117776
Names & identifiers
- Preferred name
- 3-(1-hydroxy-3-phenylpropan-2-yl)-1H-quinoxalin-2-one
- IUPAC
- 3-(1-hydroxy-3-phenylpropan-2-yl)-1H-quinoxalin-2-one
Names & synonyms
NSC4029377621-98-9DTXSID10323055NSC-4029373-(1-Hydroxy-3-phenylpropan-2-yl)quinoxalin-2(1H)-one
Database identifiers
- CAS
7621-98-9- PubChem CID
- 345339
- DTXSID
DTXSID10323055
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 61.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 402
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Compound notes
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