N-{2-[(5-ethyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}-3-methoxybenzamide
Chemical Structure Depiction of
N-{2-[(5-ethyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}-3-methoxybenzamide
N-{2-[(5-ethyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}-3-methoxybenzamide
Compound characteristics
| Compound ID: | F518-0531 |
| Compound Name: | N-{2-[(5-ethyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}-3-methoxybenzamide |
| Molecular Weight: | 405.48 |
| Molecular Formula: | C21 H19 N5 O2 S |
| Smiles: | CCc1cc(n2c(ncn2)n1)Sc1ccccc1NC(c1cccc(c1)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.998 |
| logD: | 3.998 |
| logSw: | -4.1713 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.375 |
| InChI Key: | AEMHACUJPRSCBY-UHFFFAOYSA-N |