2-[5-{[(4-methylphenyl)methyl]sulfanyl}-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]pyridine
Chemical Structure Depiction of
2-[5-{[(4-methylphenyl)methyl]sulfanyl}-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]pyridine
2-[5-{[(4-methylphenyl)methyl]sulfanyl}-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]pyridine
Compound characteristics
| Compound ID: | Y206-1286 |
| Compound Name: | 2-[5-{[(4-methylphenyl)methyl]sulfanyl}-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]pyridine |
| Molecular Weight: | 322.43 |
| Molecular Formula: | C18 H18 N4 S |
| Smiles: | Cc1ccc(CSc2nnc(c3ccccn3)n2CC=C)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.5443 |
| logD: | 3.5442 |
| logSw: | -3.4722 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 33.267 |
| InChI Key: | UGHPYNXFRDMGNZ-UHFFFAOYSA-N |