ethyl 2-butanamido-6-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-butanamido-6-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
ethyl 2-butanamido-6-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | V018-6868 |
| Compound Name: | ethyl 2-butanamido-6-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 371.5 |
| Molecular Formula: | C21 H25 N O3 S |
| Smiles: | CCCC(Nc1c(C(=O)OCC)c2CCC(Cc2s1)c1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.0735 |
| logD: | 2.7704 |
| logSw: | -4.742 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.585 |
| InChI Key: | HEAXTEWGJOTOOX-OAHLLOKOSA-N |