4-[4-cyano-3-(trifluoromethyl)phenyl]-1-[(3,4-dimethoxyphenyl)acetyl]piperazine-2-carboxamide
Chemical Structure Depiction of
4-[4-cyano-3-(trifluoromethyl)phenyl]-1-[(3,4-dimethoxyphenyl)acetyl]piperazine-2-carboxamide
4-[4-cyano-3-(trifluoromethyl)phenyl]-1-[(3,4-dimethoxyphenyl)acetyl]piperazine-2-carboxamide
Compound characteristics
| Compound ID: | S951-5078 |
| Compound Name: | 4-[4-cyano-3-(trifluoromethyl)phenyl]-1-[(3,4-dimethoxyphenyl)acetyl]piperazine-2-carboxamide |
| Molecular Weight: | 476.45 |
| Molecular Formula: | C23 H23 F3 N4 O4 |
| Smiles: | COc1ccc(CC(N2CCN(CC2C(N)=O)c2ccc(C#N)c(c2)C(F)(F)F)=O)cc1OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.7949 |
| logD: | 1.7949 |
| logSw: | -2.5236 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 85.623 |
| InChI Key: | QTFPQMSKWMAGSG-SFHVURJKSA-N |