2-(2H-1,3-benzodioxol-5-yl)-5-{[2-(3-methylphenoxy)ethyl]sulfanyl}-1,3,4-oxadiazole
Chemical Structure Depiction of
2-(2H-1,3-benzodioxol-5-yl)-5-{[2-(3-methylphenoxy)ethyl]sulfanyl}-1,3,4-oxadiazole
2-(2H-1,3-benzodioxol-5-yl)-5-{[2-(3-methylphenoxy)ethyl]sulfanyl}-1,3,4-oxadiazole
Compound characteristics
| Compound ID: | D353-0771 |
| Compound Name: | 2-(2H-1,3-benzodioxol-5-yl)-5-{[2-(3-methylphenoxy)ethyl]sulfanyl}-1,3,4-oxadiazole |
| Molecular Weight: | 356.4 |
| Molecular Formula: | C18 H16 N2 O4 S |
| Smiles: | Cc1cccc(c1)OCCSc1nnc(c2ccc3c(c2)OCO3)o1 |
| Stereo: | ACHIRAL |
| logP: | 3.9476 |
| logD: | 3.9476 |
| logSw: | -3.9928 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 54.597 |
| InChI Key: | DDRKNMQENVDSEW-UHFFFAOYSA-N |