4-[4-cyano-3-(trifluoromethyl)phenyl]-N~1~-cyclopentyl-N~2~-methylpiperazine-1,2-dicarboxamide
Chemical Structure Depiction of
4-[4-cyano-3-(trifluoromethyl)phenyl]-N~1~-cyclopentyl-N~2~-methylpiperazine-1,2-dicarboxamide
4-[4-cyano-3-(trifluoromethyl)phenyl]-N~1~-cyclopentyl-N~2~-methylpiperazine-1,2-dicarboxamide
Compound characteristics
| Compound ID: | S951-5259 |
| Compound Name: | 4-[4-cyano-3-(trifluoromethyl)phenyl]-N~1~-cyclopentyl-N~2~-methylpiperazine-1,2-dicarboxamide |
| Molecular Weight: | 423.44 |
| Molecular Formula: | C20 H24 F3 N5 O2 |
| Smiles: | CNC(C1CN(CCN1C(NC1CCCC1)=O)c1ccc(C#N)c(c1)C(F)(F)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.3596 |
| logD: | 2.3596 |
| logSw: | -2.9801 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.9 |
| InChI Key: | RLRPYDMJMRTMRB-KRWDZBQOSA-N |