3-cyclohexyl-5-{[(3,4-dichlorophenyl)methyl]sulfanyl}-4-(4-methoxyphenyl)-4H-1,2,4-triazole
Chemical Structure Depiction of
3-cyclohexyl-5-{[(3,4-dichlorophenyl)methyl]sulfanyl}-4-(4-methoxyphenyl)-4H-1,2,4-triazole
3-cyclohexyl-5-{[(3,4-dichlorophenyl)methyl]sulfanyl}-4-(4-methoxyphenyl)-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | V008-4078 |
| Compound Name: | 3-cyclohexyl-5-{[(3,4-dichlorophenyl)methyl]sulfanyl}-4-(4-methoxyphenyl)-4H-1,2,4-triazole |
| Molecular Weight: | 448.41 |
| Molecular Formula: | C22 H23 Cl2 N3 O S |
| Salt: | not_available |
| Smiles: | COc1ccc(cc1)n1c(C2CCCCC2)nnc1SCc1ccc(c(c1)[Cl])[Cl] |
| Stereo: | ACHIRAL |
| logP: | 6.9011 |
| logD: | 6.9011 |
| logSw: | -6.6355 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 32.448 |
| InChI Key: | SSUGXZWFAAYLSI-UHFFFAOYSA-N |