4-[5-{[(2-methylphenyl)methyl]sulfanyl}-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]pyridine
Chemical Structure Depiction of
4-[5-{[(2-methylphenyl)methyl]sulfanyl}-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]pyridine
4-[5-{[(2-methylphenyl)methyl]sulfanyl}-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]pyridine
Compound characteristics
| Compound ID: | Y206-5384 |
| Compound Name: | 4-[5-{[(2-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: | Cc1ccccc1CSc1nnc(c2ccncc2)n1CC=C |
| Stereo: | ACHIRAL |
| logP: | 4.1944 |
| logD: | 4.193 |
| logSw: | -4.1049 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 33.647 |
| InChI Key: | AVAQAMUFKNXDAC-UHFFFAOYSA-N |