3-(4-methoxyphenyl)-4-(4-methylphenyl)-5-[(prop-2-yn-1-yl)sulfanyl]-4H-1,2,4-triazole
Chemical Structure Depiction of
3-(4-methoxyphenyl)-4-(4-methylphenyl)-5-[(prop-2-yn-1-yl)sulfanyl]-4H-1,2,4-triazole
3-(4-methoxyphenyl)-4-(4-methylphenyl)-5-[(prop-2-yn-1-yl)sulfanyl]-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | V011-0242 |
| Compound Name: | 3-(4-methoxyphenyl)-4-(4-methylphenyl)-5-[(prop-2-yn-1-yl)sulfanyl]-4H-1,2,4-triazole |
| Molecular Weight: | 335.43 |
| Molecular Formula: | C19 H17 N3 O S |
| Salt: | not_available |
| Smiles: | Cc1ccc(cc1)n1c(c2ccc(cc2)OC)nnc1SCC#C |
| Stereo: | ACHIRAL |
| logP: | 4.5475 |
| logD: | 4.5475 |
| logSw: | -4.3426 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 32.528 |
| InChI Key: | DORFQOZGZDGCKM-UHFFFAOYSA-N |