5-chloro-2-(ethylsulfanyl)-N-(2-fluorophenyl)pyrimidine-4-carboxamide
Chemical Structure Depiction of
5-chloro-2-(ethylsulfanyl)-N-(2-fluorophenyl)pyrimidine-4-carboxamide
5-chloro-2-(ethylsulfanyl)-N-(2-fluorophenyl)pyrimidine-4-carboxamide
Compound characteristics
| Compound ID: | D054-0087 |
| Compound Name: | 5-chloro-2-(ethylsulfanyl)-N-(2-fluorophenyl)pyrimidine-4-carboxamide |
| Molecular Weight: | 311.76 |
| Molecular Formula: | C13 H11 Cl F N3 O S |
| Smiles: | [H]N(C(c1c(cnc(n1)SCC)[Cl])=O)c1ccccc1F |
| Stereo: | ACHIRAL |
| logP: | 3.7163 |
| logD: | 3.6395 |
| logSw: | -4.0018 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.217 |
| InChI Key: | OYRDWQPZVMSQJZ-UHFFFAOYSA-N |