methyl 2-acetamido-6-bromo-7-[(3-chlorophenyl)methoxy]-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
methyl 2-acetamido-6-bromo-7-[(3-chlorophenyl)methoxy]-1-benzothiophene-3-carboxylate
methyl 2-acetamido-6-bromo-7-[(3-chlorophenyl)methoxy]-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | L068-0677 |
| Compound Name: | methyl 2-acetamido-6-bromo-7-[(3-chlorophenyl)methoxy]-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 468.75 |
| Molecular Formula: | C19 H15 Br Cl N O4 S |
| Smiles: | CC(Nc1c(C(=O)OC)c2ccc(c(c2s1)OCc1cccc(c1)[Cl])[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 5.2682 |
| logD: | 5.2577 |
| logSw: | -5.9956 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.598 |
| InChI Key: | VNQYNYDQLXPBON-UHFFFAOYSA-N |