4-[4-cyano-3-(trifluoromethyl)phenyl]-N~3~-methyl-N~1~-[(4-methylphenyl)methyl]piperazine-1,3-dicarboxamide
Chemical Structure Depiction of
4-[4-cyano-3-(trifluoromethyl)phenyl]-N~3~-methyl-N~1~-[(4-methylphenyl)methyl]piperazine-1,3-dicarboxamide
4-[4-cyano-3-(trifluoromethyl)phenyl]-N~3~-methyl-N~1~-[(4-methylphenyl)methyl]piperazine-1,3-dicarboxamide
Compound characteristics
| Compound ID: | S951-0279 |
| Compound Name: | 4-[4-cyano-3-(trifluoromethyl)phenyl]-N~3~-methyl-N~1~-[(4-methylphenyl)methyl]piperazine-1,3-dicarboxamide |
| Molecular Weight: | 459.47 |
| Molecular Formula: | C23 H24 F3 N5 O2 |
| Smiles: | Cc1ccc(CNC(N2CCN(C(C2)C(NC)=O)c2ccc(C#N)c(c2)C(F)(F)F)=O)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.5483 |
| logD: | 2.5483 |
| logSw: | -2.9993 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.809 |
| InChI Key: | QFXBLYVLNSQFED-FQEVSTJZSA-N |