1-(3,4-dimethoxyphenyl)-2-[(5-{[5-methyl-2-(propan-2-yl)phenoxy]methyl}-1,3,4-oxadiazol-2-yl)sulfanyl]ethan-1-one
Chemical Structure Depiction of
1-(3,4-dimethoxyphenyl)-2-[(5-{[5-methyl-2-(propan-2-yl)phenoxy]methyl}-1,3,4-oxadiazol-2-yl)sulfanyl]ethan-1-one
1-(3,4-dimethoxyphenyl)-2-[(5-{[5-methyl-2-(propan-2-yl)phenoxy]methyl}-1,3,4-oxadiazol-2-yl)sulfanyl]ethan-1-one
Compound characteristics
| Compound ID: | 8014-4113 |
| Compound Name: | 1-(3,4-dimethoxyphenyl)-2-[(5-{[5-methyl-2-(propan-2-yl)phenoxy]methyl}-1,3,4-oxadiazol-2-yl)sulfanyl]ethan-1-one |
| Molecular Weight: | 442.53 |
| Molecular Formula: | C23 H26 N2 O5 S |
| Smiles: | CC(C)c1ccc(C)cc1OCc1nnc(o1)SCC(c1ccc(c(c1)OC)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5381 |
| logD: | 4.5381 |
| logSw: | -4.4225 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 65.823 |
| InChI Key: | BFGBKMDOIWIJKQ-UHFFFAOYSA-N |