ethyl {[4-cyclohexyl-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetate
Chemical Structure Depiction of
ethyl {[4-cyclohexyl-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetate
ethyl {[4-cyclohexyl-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetate
Compound characteristics
| Compound ID: | V010-7867 |
| Compound Name: | ethyl {[4-cyclohexyl-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetate |
| Molecular Weight: | 375.49 |
| Molecular Formula: | C19 H25 N3 O3 S |
| Salt: | not_available |
| Smiles: | CCOC(CSc1nnc(c2ccc(cc2)OC)n1C1CCCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2792 |
| logD: | 4.2791 |
| logSw: | -4.0733 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 52.52 |
| InChI Key: | NIBZTERDBFJYQU-UHFFFAOYSA-N |