N-[(4-fluorophenyl)methyl]-2-({6-methyl-2-[4-(trifluoromethyl)phenyl]pyrimidin-4-yl}sulfanyl)acetamide
Chemical Structure Depiction of
N-[(4-fluorophenyl)methyl]-2-({6-methyl-2-[4-(trifluoromethyl)phenyl]pyrimidin-4-yl}sulfanyl)acetamide
N-[(4-fluorophenyl)methyl]-2-({6-methyl-2-[4-(trifluoromethyl)phenyl]pyrimidin-4-yl}sulfanyl)acetamide
Compound characteristics
| Compound ID: | M181-1209 |
| Compound Name: | N-[(4-fluorophenyl)methyl]-2-({6-methyl-2-[4-(trifluoromethyl)phenyl]pyrimidin-4-yl}sulfanyl)acetamide |
| Molecular Weight: | 435.44 |
| Molecular Formula: | C21 H17 F4 N3 O S |
| Smiles: | Cc1cc(nc(c2ccc(cc2)C(F)(F)F)n1)SCC(NCc1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3275 |
| logD: | 5.323 |
| logSw: | -5.3637 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.905 |
| InChI Key: | QNCCGGUOAZXNQP-UHFFFAOYSA-N |