5-chloro-N-(2,6-dimethylphenyl)-2-{[(2-fluorophenyl)methyl]sulfanyl}pyrimidine-4-carboxamide
Chemical Structure Depiction of
5-chloro-N-(2,6-dimethylphenyl)-2-{[(2-fluorophenyl)methyl]sulfanyl}pyrimidine-4-carboxamide
5-chloro-N-(2,6-dimethylphenyl)-2-{[(2-fluorophenyl)methyl]sulfanyl}pyrimidine-4-carboxamide
Compound characteristics
| Compound ID: | D233-0214 |
| Compound Name: | 5-chloro-N-(2,6-dimethylphenyl)-2-{[(2-fluorophenyl)methyl]sulfanyl}pyrimidine-4-carboxamide |
| Molecular Weight: | 401.89 |
| Molecular Formula: | C20 H17 Cl F N3 O S |
| Smiles: | [H]N(C(c1c(cnc(n1)SCc1ccccc1F)[Cl])=O)c1c(C)cccc1C |
| Stereo: | ACHIRAL |
| logP: | 5.1556 |
| logD: | 5.1523 |
| logSw: | -5.5428 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.248 |
| InChI Key: | LZYQHLBVHUIUSI-UHFFFAOYSA-N |