4-chloro-N-{2-[(5-ethyl-2-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}-2-methoxybenzamide
Chemical Structure Depiction of
4-chloro-N-{2-[(5-ethyl-2-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}-2-methoxybenzamide
4-chloro-N-{2-[(5-ethyl-2-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}-2-methoxybenzamide
Compound characteristics
| Compound ID: | F518-0643 |
| Compound Name: | 4-chloro-N-{2-[(5-ethyl-2-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}-2-methoxybenzamide |
| Molecular Weight: | 453.95 |
| Molecular Formula: | C22 H20 Cl N5 O2 S |
| Smiles: | CCc1cc(n2c(n1)nc(C)n2)Sc1ccccc1NC(c1ccc(cc1OC)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.0055 |
| logD: | 5.0044 |
| logSw: | -4.9014 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.134 |
| InChI Key: | FSKMMQNAPYPYFW-UHFFFAOYSA-N |