4-[4-cyano-3-(trifluoromethyl)phenyl]-1-(3,4-dimethoxybenzoyl)piperazine-2-carboxamide
Chemical Structure Depiction of
4-[4-cyano-3-(trifluoromethyl)phenyl]-1-(3,4-dimethoxybenzoyl)piperazine-2-carboxamide
4-[4-cyano-3-(trifluoromethyl)phenyl]-1-(3,4-dimethoxybenzoyl)piperazine-2-carboxamide
Compound characteristics
| Compound ID: | S951-5077 |
| Compound Name: | 4-[4-cyano-3-(trifluoromethyl)phenyl]-1-(3,4-dimethoxybenzoyl)piperazine-2-carboxamide |
| Molecular Weight: | 462.43 |
| Molecular Formula: | C22 H21 F3 N4 O4 |
| Smiles: | COc1ccc(cc1OC)C(N1CCN(CC1C(N)=O)c1ccc(C#N)c(c1)C(F)(F)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.634 |
| logD: | 1.634 |
| logSw: | -2.4001 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.15 |
| InChI Key: | GJIOHLSADZYYEK-KRWDZBQOSA-N |