4-bromo-2-(methoxycarbonyl)phenyl 3-chloro-1-benzothiophene-2-carboxylate
Chemical Structure Depiction of
4-bromo-2-(methoxycarbonyl)phenyl 3-chloro-1-benzothiophene-2-carboxylate
4-bromo-2-(methoxycarbonyl)phenyl 3-chloro-1-benzothiophene-2-carboxylate
Compound characteristics
| Compound ID: | 8507-0587 |
| Compound Name: | 4-bromo-2-(methoxycarbonyl)phenyl 3-chloro-1-benzothiophene-2-carboxylate |
| Molecular Weight: | 425.68 |
| Molecular Formula: | C17 H10 Br Cl O4 S |
| Smiles: | COC(c1cc(ccc1OC(c1c(c2ccccc2s1)[Cl])=O)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 5.6771 |
| logD: | 5.6771 |
| logSw: | -6.0372 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 42.624 |
| InChI Key: | WZIYRXZYVVARMM-UHFFFAOYSA-N |