1-[4-cyano-3-(trifluoromethyl)phenyl]-N-methyl-4-(1,3-thiazole-4-carbonyl)piperazine-2-carboxamide
Chemical Structure Depiction of
1-[4-cyano-3-(trifluoromethyl)phenyl]-N-methyl-4-(1,3-thiazole-4-carbonyl)piperazine-2-carboxamide
1-[4-cyano-3-(trifluoromethyl)phenyl]-N-methyl-4-(1,3-thiazole-4-carbonyl)piperazine-2-carboxamide
Compound characteristics
| Compound ID: | S951-0225 |
| Compound Name: | 1-[4-cyano-3-(trifluoromethyl)phenyl]-N-methyl-4-(1,3-thiazole-4-carbonyl)piperazine-2-carboxamide |
| Molecular Weight: | 423.41 |
| Molecular Formula: | C18 H16 F3 N5 O2 S |
| Smiles: | CNC(C1CN(CCN1c1ccc(C#N)c(c1)C(F)(F)F)C(c1cscn1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.453 |
| logD: | 1.453 |
| logSw: | -2.5528 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.294 |
| InChI Key: | XQXAEGAOCNJQGM-HNNXBMFYSA-N |