ethyl 7-oxo-6-(phenylsulfanyl)-2-propanamido-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 7-oxo-6-(phenylsulfanyl)-2-propanamido-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
ethyl 7-oxo-6-(phenylsulfanyl)-2-propanamido-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | 3473-2881 |
| Compound Name: | ethyl 7-oxo-6-(phenylsulfanyl)-2-propanamido-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 403.52 |
| Molecular Formula: | C20 H21 N O4 S2 |
| Smiles: | CCC(Nc1c(C(=O)OCC)c2CCC(C(c2s1)=O)Sc1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.093 |
| logD: | 1.4354 |
| logSw: | -4.2213 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.731 |
| InChI Key: | MYJPLTUPQWUJOI-AWEZNQCLSA-N |