3-benzyl-5-{[(2-methylphenyl)methyl]sulfanyl}-4-(prop-2-en-1-yl)-4H-1,2,4-triazole
Chemical Structure Depiction of
3-benzyl-5-{[(2-methylphenyl)methyl]sulfanyl}-4-(prop-2-en-1-yl)-4H-1,2,4-triazole
3-benzyl-5-{[(2-methylphenyl)methyl]sulfanyl}-4-(prop-2-en-1-yl)-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | Y205-8696 |
| Compound Name: | 3-benzyl-5-{[(2-methylphenyl)methyl]sulfanyl}-4-(prop-2-en-1-yl)-4H-1,2,4-triazole |
| Molecular Weight: | 335.47 |
| Molecular Formula: | C20 H21 N3 S |
| Smiles: | Cc1ccccc1CSc1nnc(Cc2ccccc2)n1CC=C |
| Stereo: | ACHIRAL |
| logP: | 5.0763 |
| logD: | 5.0763 |
| logSw: | -4.899 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 25.1953 |
| InChI Key: | FWVSNRDKVPLHIP-UHFFFAOYSA-N |