ethyl 2-(3-{5-[(4-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}propanamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-(3-{5-[(4-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}propanamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
ethyl 2-(3-{5-[(4-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}propanamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | 2109-0618 |
| Compound Name: | ethyl 2-(3-{5-[(4-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}propanamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 530.68 |
| Molecular Formula: | C25 H26 N2 O5 S3 |
| Smiles: | CCOC(c1c2CCCCc2sc1NC(CCN1C(/C(=C/c2ccc(cc2)OC)SC1=S)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9256 |
| logD: | 2.2624 |
| logSw: | -4.6156 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.582 |
| InChI Key: | UWFUAXMQVFDUDV-UHFFFAOYSA-N |