ethyl 7-oxo-2-[2-(phenylsulfanyl)acetamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 7-oxo-2-[2-(phenylsulfanyl)acetamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
ethyl 7-oxo-2-[2-(phenylsulfanyl)acetamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | 8006-2400 |
| Compound Name: | ethyl 7-oxo-2-[2-(phenylsulfanyl)acetamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 389.49 |
| Molecular Formula: | C19 H19 N O4 S2 |
| Smiles: | CCOC(c1c2CCCC(c2sc1NC(CSc1ccccc1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7822 |
| logD: | 1.0716 |
| logSw: | -4.2324 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.833 |
| InChI Key: | CXDDLBQTIALQTD-UHFFFAOYSA-N |