N-[4-chloro-2-(trifluoromethyl)phenyl]-2-{[7-(4-methylphenyl)pyrimido[4,5-d]pyrimidin-4-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-[4-chloro-2-(trifluoromethyl)phenyl]-2-{[7-(4-methylphenyl)pyrimido[4,5-d]pyrimidin-4-yl]sulfanyl}acetamide
N-[4-chloro-2-(trifluoromethyl)phenyl]-2-{[7-(4-methylphenyl)pyrimido[4,5-d]pyrimidin-4-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | M143-0765 |
| Compound Name: | N-[4-chloro-2-(trifluoromethyl)phenyl]-2-{[7-(4-methylphenyl)pyrimido[4,5-d]pyrimidin-4-yl]sulfanyl}acetamide |
| Molecular Weight: | 489.9 |
| Molecular Formula: | C22 H15 Cl F3 N5 O S |
| Smiles: | Cc1ccc(cc1)c1ncc2c(ncnc2n1)SCC(Nc1ccc(cc1C(F)(F)F)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.7659 |
| logD: | 5.7656 |
| logSw: | -5.9601 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.222 |
| InChI Key: | PDDGNFHQDZWKNO-UHFFFAOYSA-N |