ethyl 7-[(3-cyanophenyl)methoxy]-6-methyl-2-propanamido-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 7-[(3-cyanophenyl)methoxy]-6-methyl-2-propanamido-1-benzothiophene-3-carboxylate
ethyl 7-[(3-cyanophenyl)methoxy]-6-methyl-2-propanamido-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | L068-0055 |
| Compound Name: | ethyl 7-[(3-cyanophenyl)methoxy]-6-methyl-2-propanamido-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 422.5 |
| Molecular Formula: | C23 H22 N2 O4 S |
| Smiles: | CCC(Nc1c(C(=O)OCC)c2ccc(C)c(c2s1)OCc1cccc(C#N)c1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.914 |
| logD: | 4.9013 |
| logSw: | -4.9945 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.121 |
| InChI Key: | JOOSMHMYVRXAED-UHFFFAOYSA-N |