2-({6-[(3-chloro-4-fluorophenyl)methyl]-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}sulfanyl)-N-(3,5-dimethylphenyl)acetamide
Chemical Structure Depiction of
2-({6-[(3-chloro-4-fluorophenyl)methyl]-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}sulfanyl)-N-(3,5-dimethylphenyl)acetamide
2-({6-[(3-chloro-4-fluorophenyl)methyl]-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}sulfanyl)-N-(3,5-dimethylphenyl)acetamide
Compound characteristics
| Compound ID: | K788-0058 |
| Compound Name: | 2-({6-[(3-chloro-4-fluorophenyl)methyl]-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}sulfanyl)-N-(3,5-dimethylphenyl)acetamide |
| Molecular Weight: | 483.99 |
| Molecular Formula: | C24 H23 Cl F N5 O S |
| Smiles: | Cc1cc(C)cc(c1)NC(CSc1nc2nc(C)c(Cc3ccc(c(c3)[Cl])F)c(C)n2n1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3586 |
| logD: | 5.3586 |
| logSw: | -5.8671 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.704 |
| InChI Key: | OHKQGVLEQUOSST-UHFFFAOYSA-N |