1-[4-cyano-3-(trifluoromethyl)phenyl]-4-(3,5-dimethyl-1,2-oxazole-4-carbonyl)-N-methylpiperazine-2-carboxamide
Chemical Structure Depiction of
1-[4-cyano-3-(trifluoromethyl)phenyl]-4-(3,5-dimethyl-1,2-oxazole-4-carbonyl)-N-methylpiperazine-2-carboxamide
1-[4-cyano-3-(trifluoromethyl)phenyl]-4-(3,5-dimethyl-1,2-oxazole-4-carbonyl)-N-methylpiperazine-2-carboxamide
Compound characteristics
| Compound ID: | S951-0307 |
| Compound Name: | 1-[4-cyano-3-(trifluoromethyl)phenyl]-4-(3,5-dimethyl-1,2-oxazole-4-carbonyl)-N-methylpiperazine-2-carboxamide |
| Molecular Weight: | 435.4 |
| Molecular Formula: | C20 H20 F3 N5 O3 |
| Smiles: | Cc1c(C(N2CCN(C(C2)C(NC)=O)c2ccc(C#N)c(c2)C(F)(F)F)=O)c(C)on1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.2484 |
| logD: | 1.2484 |
| logSw: | -2.4048 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.704 |
| InChI Key: | PPAULUUZDCXWKG-INIZCTEOSA-N |