methyl 3-[(3-chloro-4-methylphenyl)sulfamoyl]-4-fluoro-1-benzothiophene-2-carboxylate
Chemical Structure Depiction of
methyl 3-[(3-chloro-4-methylphenyl)sulfamoyl]-4-fluoro-1-benzothiophene-2-carboxylate
methyl 3-[(3-chloro-4-methylphenyl)sulfamoyl]-4-fluoro-1-benzothiophene-2-carboxylate
Compound characteristics
| Compound ID: | G226-0177 |
| Compound Name: | methyl 3-[(3-chloro-4-methylphenyl)sulfamoyl]-4-fluoro-1-benzothiophene-2-carboxylate |
| Molecular Weight: | 413.87 |
| Molecular Formula: | C17 H13 Cl F N O4 S2 |
| Smiles: | Cc1ccc(cc1[Cl])NS(c1c2c(cccc2sc1C(=O)OC)F)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2912 |
| logD: | 4.413 |
| logSw: | -6.0463 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.809 |
| InChI Key: | HAQVWPKSRRDXER-UHFFFAOYSA-N |