methyl 3-[(2H-1,3-benzodioxol-5-yl)sulfamoyl]-4-fluoro-1-benzothiophene-2-carboxylate
Chemical Structure Depiction of
methyl 3-[(2H-1,3-benzodioxol-5-yl)sulfamoyl]-4-fluoro-1-benzothiophene-2-carboxylate
methyl 3-[(2H-1,3-benzodioxol-5-yl)sulfamoyl]-4-fluoro-1-benzothiophene-2-carboxylate
Compound characteristics
| Compound ID: | G226-0205 |
| Compound Name: | methyl 3-[(2H-1,3-benzodioxol-5-yl)sulfamoyl]-4-fluoro-1-benzothiophene-2-carboxylate |
| Molecular Weight: | 409.41 |
| Molecular Formula: | C17 H12 F N O6 S2 |
| Smiles: | COC(c1c(c2c(cccc2s1)F)S(Nc1ccc2c(c1)OCO2)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7341 |
| logD: | 3.3694 |
| logSw: | -4.2274 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.924 |
| InChI Key: | XFYUCTUCLGTMLQ-UHFFFAOYSA-N |