5-chloro-2-{[(4-fluorophenyl)methyl]sulfanyl}-N-(2-methylphenyl)pyrimidine-4-carboxamide
Chemical Structure Depiction of
5-chloro-2-{[(4-fluorophenyl)methyl]sulfanyl}-N-(2-methylphenyl)pyrimidine-4-carboxamide
5-chloro-2-{[(4-fluorophenyl)methyl]sulfanyl}-N-(2-methylphenyl)pyrimidine-4-carboxamide
Compound characteristics
| Compound ID: | D233-0003 |
| Compound Name: | 5-chloro-2-{[(4-fluorophenyl)methyl]sulfanyl}-N-(2-methylphenyl)pyrimidine-4-carboxamide |
| Molecular Weight: | 387.86 |
| Molecular Formula: | C19 H15 Cl F N3 O S |
| Smiles: | [H]N(C(c1c(cnc(n1)SCc1ccc(cc1)F)[Cl])=O)c1ccccc1C |
| Stereo: | ACHIRAL |
| logP: | 4.5662 |
| logD: | 4.5643 |
| logSw: | -4.4437 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.946 |
| InChI Key: | WVWCIFDCGMMTKW-UHFFFAOYSA-N |