methyl 3-[(3-chloro-4-methoxyphenyl)sulfamoyl]-1-benzothiophene-2-carboxylate
Chemical Structure Depiction of
methyl 3-[(3-chloro-4-methoxyphenyl)sulfamoyl]-1-benzothiophene-2-carboxylate
methyl 3-[(3-chloro-4-methoxyphenyl)sulfamoyl]-1-benzothiophene-2-carboxylate
Compound characteristics
| Compound ID: | G226-0034 |
| Compound Name: | methyl 3-[(3-chloro-4-methoxyphenyl)sulfamoyl]-1-benzothiophene-2-carboxylate |
| Molecular Weight: | 411.88 |
| Molecular Formula: | C17 H14 Cl N O5 S2 |
| Smiles: | COC(c1c(c2ccccc2s1)S(Nc1ccc(c(c1)[Cl])OC)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2611 |
| logD: | 3.202 |
| logSw: | -4.412 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.439 |
| InChI Key: | IWNXJUJVIGIWBV-UHFFFAOYSA-N |