ethyl 6-tert-butyl-2-(pent-4-enamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 6-tert-butyl-2-(pent-4-enamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
ethyl 6-tert-butyl-2-(pent-4-enamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | V008-8065 |
| Compound Name: | ethyl 6-tert-butyl-2-(pent-4-enamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 363.52 |
| Molecular Formula: | C20 H29 N O3 S |
| Smiles: | CCOC(c1c2CCC(Cc2sc1NC(CCC=C)=O)C(C)(C)C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.3353 |
| logD: | 2.672 |
| logSw: | -5.2865 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.856 |
| InChI Key: | QIPUQNVNGLMWHZ-CYBMUJFWSA-N |