2-(2H-1,3-benzodioxol-5-yl)-5-{[2-(4-chlorophenoxy)ethyl]sulfanyl}-1,3,4-oxadiazole
Chemical Structure Depiction of
2-(2H-1,3-benzodioxol-5-yl)-5-{[2-(4-chlorophenoxy)ethyl]sulfanyl}-1,3,4-oxadiazole
2-(2H-1,3-benzodioxol-5-yl)-5-{[2-(4-chlorophenoxy)ethyl]sulfanyl}-1,3,4-oxadiazole
Compound characteristics
| Compound ID: | D353-0776 |
| Compound Name: | 2-(2H-1,3-benzodioxol-5-yl)-5-{[2-(4-chlorophenoxy)ethyl]sulfanyl}-1,3,4-oxadiazole |
| Molecular Weight: | 376.82 |
| Molecular Formula: | C17 H13 Cl N2 O4 S |
| Smiles: | C(CSc1nnc(c2ccc3c(c2)OCO3)o1)Oc1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.0511 |
| logD: | 4.0511 |
| logSw: | -4.5642 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 54.597 |
| InChI Key: | FTLUJAVJVSUTLE-UHFFFAOYSA-N |