ethyl 2-[2-(acetyloxy)-2-methylpropanamido]-6-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-[2-(acetyloxy)-2-methylpropanamido]-6-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
ethyl 2-[2-(acetyloxy)-2-methylpropanamido]-6-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | V001-7412 |
| Compound Name: | ethyl 2-[2-(acetyloxy)-2-methylpropanamido]-6-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 429.53 |
| Molecular Formula: | C23 H27 N O5 S |
| Smiles: | CCOC(c1c2CCC(Cc2sc1NC(C(C)(C)OC(C)=O)=O)c1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.544 |
| logD: | 1.9635 |
| logSw: | -4.506 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.75 |
| InChI Key: | DRARBWSRDPDTNE-MRXNPFEDSA-N |