2-({6-[(2-chloro-4-fluorophenyl)methyl]-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}sulfanyl)-N-(3-chloro-4-methylphenyl)acetamide
Chemical Structure Depiction of
2-({6-[(2-chloro-4-fluorophenyl)methyl]-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}sulfanyl)-N-(3-chloro-4-methylphenyl)acetamide
2-({6-[(2-chloro-4-fluorophenyl)methyl]-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}sulfanyl)-N-(3-chloro-4-methylphenyl)acetamide
Compound characteristics
| Compound ID: | K784-5907 |
| Compound Name: | 2-({6-[(2-chloro-4-fluorophenyl)methyl]-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}sulfanyl)-N-(3-chloro-4-methylphenyl)acetamide |
| Molecular Weight: | 504.41 |
| Molecular Formula: | C23 H20 Cl2 F N5 O S |
| Smiles: | Cc1ccc(cc1[Cl])NC(CSc1nc2nc(C)c(Cc3ccc(cc3[Cl])F)c(C)n2n1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.3664 |
| logD: | 6.3663 |
| logSw: | -6.2241 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.704 |
| InChI Key: | NALIHQIWCRYQGK-UHFFFAOYSA-N |