ethyl 2-(3-butanamidobenzamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-(3-butanamidobenzamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
ethyl 2-(3-butanamidobenzamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | Y031-0158 |
| Compound Name: | ethyl 2-(3-butanamidobenzamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 414.52 |
| Molecular Formula: | C22 H26 N2 O4 S |
| Smiles: | CCCC(Nc1cccc(c1)C(Nc1c(C(=O)OCC)c2CCCCc2s1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6266 |
| logD: | 0.9442 |
| logSw: | -4.5235 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.948 |
| InChI Key: | MQAUJOZODQBIQC-UHFFFAOYSA-N |