3-{[(2-cyclohexyl-1,3-thiazol-4-yl)methyl]sulfanyl}-5-(4-methoxyphenyl)-4-phenyl-4H-1,2,4-triazole
Chemical Structure Depiction of
3-{[(2-cyclohexyl-1,3-thiazol-4-yl)methyl]sulfanyl}-5-(4-methoxyphenyl)-4-phenyl-4H-1,2,4-triazole
3-{[(2-cyclohexyl-1,3-thiazol-4-yl)methyl]sulfanyl}-5-(4-methoxyphenyl)-4-phenyl-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | 8017-3906 |
| Compound Name: | 3-{[(2-cyclohexyl-1,3-thiazol-4-yl)methyl]sulfanyl}-5-(4-methoxyphenyl)-4-phenyl-4H-1,2,4-triazole |
| Molecular Weight: | 462.64 |
| Molecular Formula: | C25 H26 N4 O S2 |
| Smiles: | COc1ccc(cc1)c1nnc(n1c1ccccc1)SCc1csc(C2CCCCC2)n1 |
| Stereo: | ACHIRAL |
| logP: | 6.6461 |
| logD: | 6.646 |
| logSw: | -5.7642 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 42.678 |
| InChI Key: | KCEHXESXCPTQDW-UHFFFAOYSA-N |