3-cyclopropyl-5-{[(4-methylphenyl)methyl]sulfanyl}-4-(propan-2-yl)-4H-1,2,4-triazole
Chemical Structure Depiction of
3-cyclopropyl-5-{[(4-methylphenyl)methyl]sulfanyl}-4-(propan-2-yl)-4H-1,2,4-triazole
3-cyclopropyl-5-{[(4-methylphenyl)methyl]sulfanyl}-4-(propan-2-yl)-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | Y206-5458 |
| Compound Name: | 3-cyclopropyl-5-{[(4-methylphenyl)methyl]sulfanyl}-4-(propan-2-yl)-4H-1,2,4-triazole |
| Molecular Weight: | 287.42 |
| Molecular Formula: | C16 H21 N3 S |
| Smiles: | CC(C)n1c(C2CC2)nnc1SCc1ccc(C)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.8488 |
| logD: | 3.8443 |
| logSw: | -3.8344 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 25.8393 |
| InChI Key: | WARWGWCQNKHFPD-UHFFFAOYSA-N |