ethyl 2-(2-{[5-(2H-1,3-benzodioxol-5-yl)-1,2-oxazol-3-yl]methoxy}acetamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-(2-{[5-(2H-1,3-benzodioxol-5-yl)-1,2-oxazol-3-yl]methoxy}acetamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
ethyl 2-(2-{[5-(2H-1,3-benzodioxol-5-yl)-1,2-oxazol-3-yl]methoxy}acetamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | E613-0049 |
| Compound Name: | ethyl 2-(2-{[5-(2H-1,3-benzodioxol-5-yl)-1,2-oxazol-3-yl]methoxy}acetamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 484.53 |
| Molecular Formula: | C24 H24 N2 O7 S |
| Smiles: | CCOC(c1c2CCCCc2sc1NC(COCc1cc(c2ccc3c(c2)OCO3)on1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4694 |
| logD: | 1.9236 |
| logSw: | -4.4976 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 91.165 |
| InChI Key: | ZSERBWPBHFIATH-UHFFFAOYSA-N |