ethyl 2-(5-bromo-2-chlorobenzamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-(5-bromo-2-chlorobenzamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
ethyl 2-(5-bromo-2-chlorobenzamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | 2154-0038 |
| Compound Name: | ethyl 2-(5-bromo-2-chlorobenzamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 442.76 |
| Molecular Formula: | C18 H17 Br Cl N O3 S |
| Smiles: | CCOC(c1c2CCCCc2sc1NC(c1cc(ccc1[Cl])[Br])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.5695 |
| logD: | 0.0967 |
| logSw: | -6.1974 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.798 |
| InChI Key: | VCHKBGSSDDVFEN-UHFFFAOYSA-N |