methyl 3-{[4-(dimethylamino)phenyl]sulfamoyl}-4-fluoro-1-benzothiophene-2-carboxylate
Chemical Structure Depiction of
methyl 3-{[4-(dimethylamino)phenyl]sulfamoyl}-4-fluoro-1-benzothiophene-2-carboxylate
methyl 3-{[4-(dimethylamino)phenyl]sulfamoyl}-4-fluoro-1-benzothiophene-2-carboxylate
Compound characteristics
| Compound ID: | G226-0213 |
| Compound Name: | methyl 3-{[4-(dimethylamino)phenyl]sulfamoyl}-4-fluoro-1-benzothiophene-2-carboxylate |
| Molecular Weight: | 408.47 |
| Molecular Formula: | C18 H17 F N2 O4 S2 |
| Smiles: | CN(C)c1ccc(cc1)NS(c1c2c(cccc2sc1C(=O)OC)F)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0241 |
| logD: | 3.9249 |
| logSw: | -4.385 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.613 |
| InChI Key: | VWFZNDAFBUMLTE-UHFFFAOYSA-N |