3-({[4-(2-methoxyphenyl)-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-methyl-N-propylbenzamide
Chemical Structure Depiction of
3-({[4-(2-methoxyphenyl)-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-methyl-N-propylbenzamide
3-({[4-(2-methoxyphenyl)-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-methyl-N-propylbenzamide
Compound characteristics
| Compound ID: | V030-1475 |
| Compound Name: | 3-({[4-(2-methoxyphenyl)-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-methyl-N-propylbenzamide |
| Molecular Weight: | 473.6 |
| Molecular Formula: | C26 H27 N5 O2 S |
| Salt: | not_available |
| Smiles: | CCCN(C)C(c1cccc(CSc2nnc(c3cccnc3)n2c2ccccc2OC)c1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3451 |
| logD: | 3.3409 |
| logSw: | -3.5285 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 57.96 |
| InChI Key: | RVLXBVOLJAJQBF-UHFFFAOYSA-N |