(S)-3-(2,5-Dimethoxyphenyl)piperazin-2-one
Basic information
- CAS
1228566-33-3- Standard SMILES
COc1ccc(OC)c([C@@H]2NCCNC2=O)c1- InChIKey
QZANLZAYTJLUNO-NSHDSACASA-N- Molecular formula
- C12H16N2O3
- Average molar mass
- 236.27 g/mol
- Monoisotopic mass
- 236.11609238
Names & identifiers
- Preferred name
- (S)-3-(2,5-Dimethoxyphenyl)piperazin-2-one
- IUPAC
- (3S)-3-(2,5-dimethoxyphenyl)piperazin-2-one
Names & synonyms
1228566-33-3(S)-3-(2,5-Dimethoxyphenyl)piperazin-2-oneDTXSID001261235(3S)-3-(2,5-Dimethoxyphenyl)-2-piperazinone(3S)-3-(2,5-DIMETHOXYPHENYL)PIPERAZIN-2-ONE
Database identifiers
- CAS
1228566-33-3- PubChem CID
- 72209656
- DTXSID
DTXSID001261235
Properties
Computed structural properties
- XLogP
- 0.6
- Topological polar surface area
- 59.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 272
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…