N-ethyl-1-[6-({2-oxo-2-[3-(trifluoromethyl)anilino]ethyl}sulfanyl)pyrimidin-4-yl]piperidine-4-carboxamide
Chemical Structure Depiction of
N-ethyl-1-[6-({2-oxo-2-[3-(trifluoromethyl)anilino]ethyl}sulfanyl)pyrimidin-4-yl]piperidine-4-carboxamide
N-ethyl-1-[6-({2-oxo-2-[3-(trifluoromethyl)anilino]ethyl}sulfanyl)pyrimidin-4-yl]piperidine-4-carboxamide
Compound characteristics
| Compound ID: | M779-1330 |
| Compound Name: | N-ethyl-1-[6-({2-oxo-2-[3-(trifluoromethyl)anilino]ethyl}sulfanyl)pyrimidin-4-yl]piperidine-4-carboxamide |
| Molecular Weight: | 467.51 |
| Molecular Formula: | C21 H24 F3 N5 O2 S |
| Smiles: | CCNC(C1CCN(CC1)c1cc(ncn1)SCC(Nc1cccc(c1)C(F)(F)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8855 |
| logD: | 3.8849 |
| logSw: | -3.8272 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 69.514 |
| InChI Key: | XAZNUEZSCYPZLW-UHFFFAOYSA-N |