ethyl 6-ethyl-2-(2-methylbut-2-enamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 6-ethyl-2-(2-methylbut-2-enamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
ethyl 6-ethyl-2-(2-methylbut-2-enamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | V007-2376 |
| Compound Name: | ethyl 6-ethyl-2-(2-methylbut-2-enamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 335.46 |
| Molecular Formula: | C18 H25 N O3 S |
| Smiles: | CCC1CCc2c(C(=O)OCC)c(NC(C(\C)=C\C)=O)sc2C1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.7071 |
| logD: | 0.743 |
| logSw: | -4.5218 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.07 |
| InChI Key: | BEJMNCZXHPGSMG-GFCCVEGCSA-N |