3-chloro-N-{2-[(5-methyl-2-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}benzamide
Chemical Structure Depiction of
3-chloro-N-{2-[(5-methyl-2-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}benzamide
3-chloro-N-{2-[(5-methyl-2-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}benzamide
Compound characteristics
| Compound ID: | F518-0245 |
| Compound Name: | 3-chloro-N-{2-[(5-methyl-2-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}benzamide |
| Molecular Weight: | 471.97 |
| Molecular Formula: | C25 H18 Cl N5 O S |
| Smiles: | Cc1cc(n2c(n1)nc(c1ccccc1)n2)Sc1ccccc1NC(c1cccc(c1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.8831 |
| logD: | 5.8829 |
| logSw: | -5.9162 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.93 |
| InChI Key: | NKZJWJPECRVODE-UHFFFAOYSA-N |