3-{[(4-chlorophenyl)methyl]sulfanyl}-5-(4-fluorophenyl)-4-methyl-4H-1,2,4-triazole
Chemical Structure Depiction of
3-{[(4-chlorophenyl)methyl]sulfanyl}-5-(4-fluorophenyl)-4-methyl-4H-1,2,4-triazole
3-{[(4-chlorophenyl)methyl]sulfanyl}-5-(4-fluorophenyl)-4-methyl-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | Y205-6226 |
| Compound Name: | 3-{[(4-chlorophenyl)methyl]sulfanyl}-5-(4-fluorophenyl)-4-methyl-4H-1,2,4-triazole |
| Molecular Weight: | 333.81 |
| Molecular Formula: | C16 H13 Cl F N3 S |
| Smiles: | Cn1c(c2ccc(cc2)F)nnc1SCc1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.1632 |
| logD: | 4.1632 |
| logSw: | -4.5566 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 25.0508 |
| InChI Key: | RENCUPQIPLETEZ-UHFFFAOYSA-N |