ethyl 2-(but-2-enamido)-6-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-(but-2-enamido)-6-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
ethyl 2-(but-2-enamido)-6-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | V017-6516 |
| Compound Name: | ethyl 2-(but-2-enamido)-6-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 369.48 |
| Molecular Formula: | C21 H23 N O3 S |
| Smiles: | CCOC(c1c2CCC(Cc2sc1NC(/C=C/C)=O)c1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.1775 |
| logD: | 1.4727 |
| logSw: | -5.0649 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.585 |
| InChI Key: | KHBNCBRIVWFDEZ-GZTQLTBSSA-N |