methyl 3-{[2-(3-fluoro-4-methylanilino)-2-oxoethyl](methyl)sulfamoyl}-1-benzothiophene-2-carboxylate
Chemical Structure Depiction of
methyl 3-{[2-(3-fluoro-4-methylanilino)-2-oxoethyl](methyl)sulfamoyl}-1-benzothiophene-2-carboxylate
methyl 3-{[2-(3-fluoro-4-methylanilino)-2-oxoethyl](methyl)sulfamoyl}-1-benzothiophene-2-carboxylate
Compound characteristics
| Compound ID: | G226-0814 |
| Compound Name: | methyl 3-{[2-(3-fluoro-4-methylanilino)-2-oxoethyl](methyl)sulfamoyl}-1-benzothiophene-2-carboxylate |
| Molecular Weight: | 450.51 |
| Molecular Formula: | C20 H19 F N2 O5 S2 |
| Smiles: | Cc1ccc(cc1F)NC(CN(C)S(c1c2ccccc2sc1C(=O)OC)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.938 |
| logD: | 3.9363 |
| logSw: | -4.0936 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.873 |
| InChI Key: | HWBCPVXMWHRBSR-UHFFFAOYSA-N |