4-cyclohexyl-3-{[(2-fluorophenyl)methyl]sulfanyl}-5-(4-methoxyphenyl)-4H-1,2,4-triazole
Chemical Structure Depiction of
4-cyclohexyl-3-{[(2-fluorophenyl)methyl]sulfanyl}-5-(4-methoxyphenyl)-4H-1,2,4-triazole
4-cyclohexyl-3-{[(2-fluorophenyl)methyl]sulfanyl}-5-(4-methoxyphenyl)-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | V010-5928 |
| Compound Name: | 4-cyclohexyl-3-{[(2-fluorophenyl)methyl]sulfanyl}-5-(4-methoxyphenyl)-4H-1,2,4-triazole |
| Molecular Weight: | 397.51 |
| Molecular Formula: | C22 H24 F N3 O S |
| Salt: | not_available |
| Smiles: | COc1ccc(cc1)c1nnc(n1C1CCCCC1)SCc1ccccc1F |
| Stereo: | ACHIRAL |
| logP: | 5.9567 |
| logD: | 5.9567 |
| logSw: | -5.53 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 32.089 |
| InChI Key: | WADKMIGUHXXVEL-UHFFFAOYSA-N |