4-cyclohexyl-3-{[(2,6-difluorophenyl)methyl]sulfanyl}-5-(4-methoxyphenyl)-4H-1,2,4-triazole
Chemical Structure Depiction of
4-cyclohexyl-3-{[(2,6-difluorophenyl)methyl]sulfanyl}-5-(4-methoxyphenyl)-4H-1,2,4-triazole
4-cyclohexyl-3-{[(2,6-difluorophenyl)methyl]sulfanyl}-5-(4-methoxyphenyl)-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | V007-2292 |
| Compound Name: | 4-cyclohexyl-3-{[(2,6-difluorophenyl)methyl]sulfanyl}-5-(4-methoxyphenyl)-4H-1,2,4-triazole |
| Molecular Weight: | 415.5 |
| Molecular Formula: | C22 H23 F2 N3 O S |
| Salt: | not_available |
| Smiles: | COc1ccc(cc1)c1nnc(n1C1CCCCC1)SCc1c(cccc1F)F |
| Stereo: | ACHIRAL |
| logP: | 5.8859 |
| logD: | 5.8859 |
| logSw: | -5.5088 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 32.089 |
| InChI Key: | NZULJBPETWPTQF-UHFFFAOYSA-N |