ethyl 2-(3-bromo-4-ethoxybenzamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-(3-bromo-4-ethoxybenzamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
ethyl 2-(3-bromo-4-ethoxybenzamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | 2026-4026 |
| Compound Name: | ethyl 2-(3-bromo-4-ethoxybenzamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 452.37 |
| Molecular Formula: | C20 H22 Br N O4 S |
| Smiles: | CCOC(c1c2CCCCc2sc1NC(c1ccc(c(c1)[Br])OCC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.144 |
| logD: | 0.9147 |
| logSw: | -5.1798 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.008 |
| InChI Key: | VJZWQGUOYKHAGQ-UHFFFAOYSA-N |