ethyl 2-[2-(3-benzyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-yl)acetamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-[2-(3-benzyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-yl)acetamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
ethyl 2-[2-(3-benzyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-yl)acetamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | 8018-9639 |
| Compound Name: | ethyl 2-[2-(3-benzyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-yl)acetamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 488.65 |
| Molecular Formula: | C23 H24 N2 O4 S3 |
| Smiles: | CCOC(c1c2CCCCc2sc1NC(CC1C(N(Cc2ccccc2)C(=S)S1)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.6753 |
| logD: | 2.0121 |
| logSw: | -4.4915 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.06 |
| InChI Key: | UJKFQHWUCDLIIE-QGZVFWFLSA-N |