1-[6-({2-oxo-2-[3-(trifluoromethyl)anilino]ethyl}sulfanyl)pyrimidin-4-yl]-N-propylpiperidine-4-carboxamide
Chemical Structure Depiction of
1-[6-({2-oxo-2-[3-(trifluoromethyl)anilino]ethyl}sulfanyl)pyrimidin-4-yl]-N-propylpiperidine-4-carboxamide
1-[6-({2-oxo-2-[3-(trifluoromethyl)anilino]ethyl}sulfanyl)pyrimidin-4-yl]-N-propylpiperidine-4-carboxamide
Compound characteristics
| Compound ID: | M779-1094 |
| Compound Name: | 1-[6-({2-oxo-2-[3-(trifluoromethyl)anilino]ethyl}sulfanyl)pyrimidin-4-yl]-N-propylpiperidine-4-carboxamide |
| Molecular Weight: | 481.54 |
| Molecular Formula: | C22 H26 F3 N5 O2 S |
| Smiles: | CCCNC(C1CCN(CC1)c1cc(ncn1)SCC(Nc1cccc(c1)C(F)(F)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3517 |
| logD: | 4.3511 |
| logSw: | -4.1758 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 69.729 |
| InChI Key: | BRIVCUDVLOLFIZ-UHFFFAOYSA-N |