ethyl 2-benzamido-7-oxo-6-(phenylsulfanyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-benzamido-7-oxo-6-(phenylsulfanyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
ethyl 2-benzamido-7-oxo-6-(phenylsulfanyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | 5989-1120 |
| Compound Name: | ethyl 2-benzamido-7-oxo-6-(phenylsulfanyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 451.56 |
| Molecular Formula: | C24 H21 N O4 S2 |
| Smiles: | CCOC(c1c2CCC(C(c2sc1NC(c1ccccc1)=O)=O)Sc1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.1368 |
| logD: | 0.9712 |
| logSw: | -5.1753 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.673 |
| InChI Key: | MISFEAWMJMWEPH-SFHVURJKSA-N |