N-(3-chloro-4-fluorophenyl)-2-({5,7-dimethyl-6-[(4-methylphenyl)methyl][1,2,4]triazolo[1,5-a]pyrimidin-2-yl}sulfanyl)acetamide
Chemical Structure Depiction of
N-(3-chloro-4-fluorophenyl)-2-({5,7-dimethyl-6-[(4-methylphenyl)methyl][1,2,4]triazolo[1,5-a]pyrimidin-2-yl}sulfanyl)acetamide
N-(3-chloro-4-fluorophenyl)-2-({5,7-dimethyl-6-[(4-methylphenyl)methyl][1,2,4]triazolo[1,5-a]pyrimidin-2-yl}sulfanyl)acetamide
Compound characteristics
| Compound ID: | K788-0049 |
| Compound Name: | N-(3-chloro-4-fluorophenyl)-2-({5,7-dimethyl-6-[(4-methylphenyl)methyl][1,2,4]triazolo[1,5-a]pyrimidin-2-yl}sulfanyl)acetamide |
| Molecular Weight: | 469.97 |
| Molecular Formula: | C23 H21 Cl F N5 O S |
| Smiles: | Cc1ccc(Cc2c(C)nc3nc(nn3c2C)SCC(Nc2ccc(c(c2)[Cl])F)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.2007 |
| logD: | 5.1925 |
| logSw: | -5.6259 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.704 |
| InChI Key: | FCCSSLYJQNVTJT-UHFFFAOYSA-N |