4-[4-cyano-3-(trifluoromethyl)phenyl]-N,N-dimethyl-1-(3-methylbenzoyl)piperazine-2-carboxamide
Chemical Structure Depiction of
4-[4-cyano-3-(trifluoromethyl)phenyl]-N,N-dimethyl-1-(3-methylbenzoyl)piperazine-2-carboxamide
4-[4-cyano-3-(trifluoromethyl)phenyl]-N,N-dimethyl-1-(3-methylbenzoyl)piperazine-2-carboxamide
Compound characteristics
| Compound ID: | S951-5588 |
| Compound Name: | 4-[4-cyano-3-(trifluoromethyl)phenyl]-N,N-dimethyl-1-(3-methylbenzoyl)piperazine-2-carboxamide |
| Molecular Weight: | 444.46 |
| Molecular Formula: | C23 H23 F3 N4 O2 |
| Smiles: | Cc1cccc(c1)C(N1CCN(CC1C(N(C)C)=O)c1ccc(C#N)c(c1)C(F)(F)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6421 |
| logD: | 2.6421 |
| logSw: | -2.9717 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 52.831 |
| InChI Key: | ZQBGDCZADHIZSE-FQEVSTJZSA-N |