ethyl 2-(3,3-dimethylbutanamido)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-(3,3-dimethylbutanamido)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
ethyl 2-(3,3-dimethylbutanamido)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | V008-6349 |
| Compound Name: | ethyl 2-(3,3-dimethylbutanamido)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 337.48 |
| Molecular Formula: | C18 H27 N O3 S |
| Smiles: | CCOC(c1c2CCC(C)Cc2sc1NC(CC(C)(C)C)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.7786 |
| logD: | 2.0647 |
| logSw: | -4.5971 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.856 |
| InChI Key: | NBGGCNPCVIBSBF-LLVKDONJSA-N |