4-[4-cyano-3-(trifluoromethyl)phenyl]-N~2~-cyclopropyl-N~1~-(3-methoxypropyl)piperazine-1,2-dicarboxamide
Chemical Structure Depiction of
4-[4-cyano-3-(trifluoromethyl)phenyl]-N~2~-cyclopropyl-N~1~-(3-methoxypropyl)piperazine-1,2-dicarboxamide
4-[4-cyano-3-(trifluoromethyl)phenyl]-N~2~-cyclopropyl-N~1~-(3-methoxypropyl)piperazine-1,2-dicarboxamide
Compound characteristics
| Compound ID: | S951-5375 |
| Compound Name: | 4-[4-cyano-3-(trifluoromethyl)phenyl]-N~2~-cyclopropyl-N~1~-(3-methoxypropyl)piperazine-1,2-dicarboxamide |
| Molecular Weight: | 453.46 |
| Molecular Formula: | C21 H26 F3 N5 O3 |
| Smiles: | COCCCNC(N1CCN(CC1C(NC1CC1)=O)c1ccc(C#N)c(c1)C(F)(F)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.2065 |
| logD: | 2.2065 |
| logSw: | -3.0144 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 79.899 |
| InChI Key: | IXABVOFYIDSPAR-SFHVURJKSA-N |