ethyl 6-tert-butyl-2-(6-methoxy-6-oxohexanamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 6-tert-butyl-2-(6-methoxy-6-oxohexanamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
ethyl 6-tert-butyl-2-(6-methoxy-6-oxohexanamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | V001-6869 |
| Compound Name: | ethyl 6-tert-butyl-2-(6-methoxy-6-oxohexanamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 423.57 |
| Molecular Formula: | C22 H33 N O5 S |
| Smiles: | CCOC(c1c2CCC(Cc2sc1NC(CCCCC(=O)OC)=O)C(C)(C)C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.3506 |
| logD: | 1.212 |
| logSw: | -4.2613 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.435 |
| InChI Key: | XPOSACPMAGDDKO-CQSZACIVSA-N |