2-chlorophenyl {[5-(3,4-dimethoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}acetate
Chemical Structure Depiction of
2-chlorophenyl {[5-(3,4-dimethoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}acetate
2-chlorophenyl {[5-(3,4-dimethoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}acetate
Compound characteristics
| Compound ID: | D394-6105 |
| Compound Name: | 2-chlorophenyl {[5-(3,4-dimethoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}acetate |
| Molecular Weight: | 406.84 |
| Molecular Formula: | C18 H15 Cl N2 O5 S |
| Smiles: | COc1ccc(cc1OC)c1nnc(o1)SCC(=O)Oc1ccccc1[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.2221 |
| logD: | 3.2221 |
| logSw: | -3.7163 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 65.466 |
| InChI Key: | HBDKVIWDJVILRQ-UHFFFAOYSA-N |