5-chloro-2-{[(4-fluorophenyl)methyl]sulfanyl}-N-(2-methoxyphenyl)pyrimidine-4-carboxamide
Chemical Structure Depiction of
5-chloro-2-{[(4-fluorophenyl)methyl]sulfanyl}-N-(2-methoxyphenyl)pyrimidine-4-carboxamide
5-chloro-2-{[(4-fluorophenyl)methyl]sulfanyl}-N-(2-methoxyphenyl)pyrimidine-4-carboxamide
Compound characteristics
| Compound ID: | D233-0005 |
| Compound Name: | 5-chloro-2-{[(4-fluorophenyl)methyl]sulfanyl}-N-(2-methoxyphenyl)pyrimidine-4-carboxamide |
| Molecular Weight: | 403.86 |
| Molecular Formula: | C19 H15 Cl F N3 O2 S |
| Smiles: | [H]N(C(c1c(cnc(n1)SCc1ccc(cc1)F)[Cl])=O)c1ccccc1OC |
| Stereo: | ACHIRAL |
| logP: | 4.5245 |
| logD: | 4.4949 |
| logSw: | -4.5152 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.576 |
| InChI Key: | OMEPUDUAKUQACL-UHFFFAOYSA-N |