1-[4-cyano-3-(trifluoromethyl)phenyl]-N-methyl-4-(3-methylbenzoyl)piperazine-2-carboxamide
Chemical Structure Depiction of
1-[4-cyano-3-(trifluoromethyl)phenyl]-N-methyl-4-(3-methylbenzoyl)piperazine-2-carboxamide
1-[4-cyano-3-(trifluoromethyl)phenyl]-N-methyl-4-(3-methylbenzoyl)piperazine-2-carboxamide
Compound characteristics
| Compound ID: | S951-0183 |
| Compound Name: | 1-[4-cyano-3-(trifluoromethyl)phenyl]-N-methyl-4-(3-methylbenzoyl)piperazine-2-carboxamide |
| Molecular Weight: | 430.43 |
| Molecular Formula: | C22 H21 F3 N4 O2 |
| Smiles: | Cc1cccc(c1)C(N1CCN(C(C1)C(NC)=O)c1ccc(C#N)c(c1)C(F)(F)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.3865 |
| logD: | 2.3865 |
| logSw: | -2.9047 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.666 |
| InChI Key: | PCJKBPGOVQWMEV-IBGZPJMESA-N |