3-{[(4-chlorophenyl)methyl]sulfanyl}-5-(2-cyclohexylethyl)-4-methyl-4H-1,2,4-triazole
Chemical Structure Depiction of
3-{[(4-chlorophenyl)methyl]sulfanyl}-5-(2-cyclohexylethyl)-4-methyl-4H-1,2,4-triazole
3-{[(4-chlorophenyl)methyl]sulfanyl}-5-(2-cyclohexylethyl)-4-methyl-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | Y205-6697 |
| Compound Name: | 3-{[(4-chlorophenyl)methyl]sulfanyl}-5-(2-cyclohexylethyl)-4-methyl-4H-1,2,4-triazole |
| Molecular Weight: | 349.92 |
| Molecular Formula: | C18 H24 Cl N3 S |
| Smiles: | Cn1c(CCC2CCCCC2)nnc1SCc1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.9082 |
| logD: | 4.9082 |
| logSw: | -4.8388 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 26.2191 |
| InChI Key: | RCTMQIDWBIVHID-UHFFFAOYSA-N |