ethyl 2-{2-[(4-methylquinolin-2-yl)sulfanyl]acetamido}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-{2-[(4-methylquinolin-2-yl)sulfanyl]acetamido}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
ethyl 2-{2-[(4-methylquinolin-2-yl)sulfanyl]acetamido}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | 3993-1764 |
| Compound Name: | ethyl 2-{2-[(4-methylquinolin-2-yl)sulfanyl]acetamido}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 440.58 |
| Molecular Formula: | C23 H24 N2 O3 S2 |
| Smiles: | CCOC(c1c2CCCCc2sc1NC(CSc1cc(C)c2ccccc2n1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.5272 |
| logD: | 3.424 |
| logSw: | -5.5237 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.277 |
| InChI Key: | SJDMPMSSSMBYLU-UHFFFAOYSA-N |