ethyl 2-acetamido-7-(hydroxyimino)-6-(phenylsulfanyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-acetamido-7-(hydroxyimino)-6-(phenylsulfanyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
ethyl 2-acetamido-7-(hydroxyimino)-6-(phenylsulfanyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | 8755-0270 |
| Compound Name: | ethyl 2-acetamido-7-(hydroxyimino)-6-(phenylsulfanyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 404.51 |
| Molecular Formula: | C19 H20 N2 O4 S2 |
| Smiles: | CCOC(c1c2CCC(/C(c2sc1NC(C)=O)=N/O)Sc1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.595 |
| logD: | 2.7654 |
| logSw: | -3.8641 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.169 |
| InChI Key: | IOEXOESFPUIGLA-AWEZNQCLSA-N |