2-[5-{[(3-methoxyphenyl)methyl]sulfanyl}-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]pyridine
Chemical Structure Depiction of
2-[5-{[(3-methoxyphenyl)methyl]sulfanyl}-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]pyridine
2-[5-{[(3-methoxyphenyl)methyl]sulfanyl}-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]pyridine
Compound characteristics
| Compound ID: | Y206-3167 |
| Compound Name: | 2-[5-{[(3-methoxyphenyl)methyl]sulfanyl}-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]pyridine |
| Molecular Weight: | 338.43 |
| Molecular Formula: | C18 H18 N4 O S |
| Smiles: | COc1cccc(CSc2nnc(c3ccccn3)n2CC=C)c1 |
| Stereo: | ACHIRAL |
| logP: | 3.4538 |
| logD: | 3.4538 |
| logSw: | -3.775 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 40.811 |
| InChI Key: | UJEDVWMKDOWGSX-UHFFFAOYSA-N |