2-bromo-4-(methoxycarbonyl)phenyl 3-chloro-1-benzothiophene-2-carboxylate
Chemical Structure Depiction of
2-bromo-4-(methoxycarbonyl)phenyl 3-chloro-1-benzothiophene-2-carboxylate
2-bromo-4-(methoxycarbonyl)phenyl 3-chloro-1-benzothiophene-2-carboxylate
Compound characteristics
| Compound ID: | 8431-0277 |
| Compound Name: | 2-bromo-4-(methoxycarbonyl)phenyl 3-chloro-1-benzothiophene-2-carboxylate |
| Molecular Weight: | 425.68 |
| Molecular Formula: | C17 H10 Br Cl O4 S |
| Smiles: | COC(c1ccc(c(c1)[Br])OC(c1c(c2ccccc2s1)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.6986 |
| logD: | 5.6986 |
| logSw: | -6.1772 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 42.624 |
| InChI Key: | ZRFDZJBTZSCRBP-UHFFFAOYSA-N |