N-{2-[(5-ethyl-2-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}-3,4-dimethoxybenzamide
Chemical Structure Depiction of
N-{2-[(5-ethyl-2-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}-3,4-dimethoxybenzamide
N-{2-[(5-ethyl-2-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}-3,4-dimethoxybenzamide
Compound characteristics
| Compound ID: | F518-0607 |
| Compound Name: | N-{2-[(5-ethyl-2-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}-3,4-dimethoxybenzamide |
| Molecular Weight: | 449.53 |
| Molecular Formula: | C23 H23 N5 O3 S |
| Smiles: | CCc1cc(n2c(n1)nc(C)n2)Sc1ccccc1NC(c1ccc(c(c1)OC)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6922 |
| logD: | 3.6921 |
| logSw: | -4.0151 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.764 |
| InChI Key: | XPMQEULCYXETAY-UHFFFAOYSA-N |