1-(4-methylphenyl)-2-{[5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}ethan-1-one
Chemical Structure Depiction of
1-(4-methylphenyl)-2-{[5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}ethan-1-one
1-(4-methylphenyl)-2-{[5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}ethan-1-one
Compound characteristics
| Compound ID: | 3103-0095 |
| Compound Name: | 1-(4-methylphenyl)-2-{[5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}ethan-1-one |
| Molecular Weight: | 400.45 |
| Molecular Formula: | C20 H20 N2 O5 S |
| Smiles: | Cc1ccc(cc1)C(CSc1nnc(c2cc(c(c(c2)OC)OC)OC)o1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2081 |
| logD: | 3.2081 |
| logSw: | -3.2824 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 66.289 |
| InChI Key: | LZLDHNUXCUAFME-UHFFFAOYSA-N |