1-[4-cyano-3-(trifluoromethyl)phenyl]-4-(2,4-dimethylbenzoyl)-N-methylpiperazine-2-carboxamide
Chemical Structure Depiction of
1-[4-cyano-3-(trifluoromethyl)phenyl]-4-(2,4-dimethylbenzoyl)-N-methylpiperazine-2-carboxamide
1-[4-cyano-3-(trifluoromethyl)phenyl]-4-(2,4-dimethylbenzoyl)-N-methylpiperazine-2-carboxamide
Compound characteristics
| Compound ID: | S951-0188 |
| Compound Name: | 1-[4-cyano-3-(trifluoromethyl)phenyl]-4-(2,4-dimethylbenzoyl)-N-methylpiperazine-2-carboxamide |
| Molecular Weight: | 444.46 |
| Molecular Formula: | C23 H23 F3 N4 O2 |
| Smiles: | Cc1ccc(C(N2CCN(C(C2)C(NC)=O)c2ccc(C#N)c(c2)C(F)(F)F)=O)c(C)c1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1241 |
| logD: | 3.1241 |
| logSw: | -3.1228 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.666 |
| InChI Key: | YVMLOPJKZBVAKN-FQEVSTJZSA-N |