ethyl 5-acetyl-2-(2-{[5-(2H-1,3-benzodioxol-5-yl)-1,2-oxazol-3-yl]methoxy}acetamido)-4-methylthiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 5-acetyl-2-(2-{[5-(2H-1,3-benzodioxol-5-yl)-1,2-oxazol-3-yl]methoxy}acetamido)-4-methylthiophene-3-carboxylate
ethyl 5-acetyl-2-(2-{[5-(2H-1,3-benzodioxol-5-yl)-1,2-oxazol-3-yl]methoxy}acetamido)-4-methylthiophene-3-carboxylate
Compound characteristics
| Compound ID: | E613-0051 |
| Compound Name: | ethyl 5-acetyl-2-(2-{[5-(2H-1,3-benzodioxol-5-yl)-1,2-oxazol-3-yl]methoxy}acetamido)-4-methylthiophene-3-carboxylate |
| Molecular Weight: | 486.5 |
| Molecular Formula: | C23 H22 N2 O8 S |
| Smiles: | CCOC(c1c(C)c(C(C)=O)sc1NC(COCc1cc(c2ccc3c(c2)OCO3)on1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3344 |
| logD: | 0.2381 |
| logSw: | -3.6026 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 105.071 |
| InChI Key: | WHBBEQMJJCCESY-UHFFFAOYSA-N |