2-[(2H-1,3-benzodioxol-5-yl)oxy]-N-{5-[2-(4-methoxyphenyl)ethyl]-1,3,4-thiadiazol-2-yl}acetamide
Chemical Structure Depiction of
2-[(2H-1,3-benzodioxol-5-yl)oxy]-N-{5-[2-(4-methoxyphenyl)ethyl]-1,3,4-thiadiazol-2-yl}acetamide
2-[(2H-1,3-benzodioxol-5-yl)oxy]-N-{5-[2-(4-methoxyphenyl)ethyl]-1,3,4-thiadiazol-2-yl}acetamide
Compound characteristics
| Compound ID: | Y031-3519 |
| Compound Name: | 2-[(2H-1,3-benzodioxol-5-yl)oxy]-N-{5-[2-(4-methoxyphenyl)ethyl]-1,3,4-thiadiazol-2-yl}acetamide |
| Molecular Weight: | 413.45 |
| Molecular Formula: | C20 H19 N3 O5 S |
| Smiles: | COc1ccc(CCc2nnc(NC(COc3ccc4c(c3)OCO4)=O)s2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.9163 |
| logD: | 3.8557 |
| logSw: | -4.1378 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.043 |
| InChI Key: | WMCKIXXWOCHFQR-UHFFFAOYSA-N |