ethyl 5-[3-(2H-1,3-benzodioxol-5-yl)propanamido]-1-benzothiophene-2-carboxylate
Chemical Structure Depiction of
ethyl 5-[3-(2H-1,3-benzodioxol-5-yl)propanamido]-1-benzothiophene-2-carboxylate
ethyl 5-[3-(2H-1,3-benzodioxol-5-yl)propanamido]-1-benzothiophene-2-carboxylate
Compound characteristics
| Compound ID: | 8019-0507 |
| Compound Name: | ethyl 5-[3-(2H-1,3-benzodioxol-5-yl)propanamido]-1-benzothiophene-2-carboxylate |
| Molecular Weight: | 397.45 |
| Molecular Formula: | C21 H19 N O5 S |
| Smiles: | CCOC(c1cc2cc(ccc2s1)NC(CCc1ccc2c(c1)OCO2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7769 |
| logD: | 4.7769 |
| logSw: | -4.712 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.732 |
| InChI Key: | XVDLXSLWIGPBHV-UHFFFAOYSA-N |