3,4-dimethoxy-N-{2-[(5-methyl-2-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}benzamide
Chemical Structure Depiction of
3,4-dimethoxy-N-{2-[(5-methyl-2-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}benzamide
3,4-dimethoxy-N-{2-[(5-methyl-2-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}benzamide
Compound characteristics
| Compound ID: | F518-0241 |
| Compound Name: | 3,4-dimethoxy-N-{2-[(5-methyl-2-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}benzamide |
| Molecular Weight: | 497.58 |
| Molecular Formula: | C27 H23 N5 O3 S |
| Smiles: | Cc1cc(n2c(n1)nc(c1ccccc1)n2)Sc1ccccc1NC(c1ccc(c(c1)OC)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8445 |
| logD: | 4.8444 |
| logSw: | -4.6547 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.191 |
| InChI Key: | GXJLHBPEWCQRJC-UHFFFAOYSA-N |