4-{butanoyl[3-(ethoxycarbonyl)-2-methyl-1-benzofuran-5-yl]sulfamoyl}benzoic acid
Chemical Structure Depiction of
4-{butanoyl[3-(ethoxycarbonyl)-2-methyl-1-benzofuran-5-yl]sulfamoyl}benzoic acid
4-{butanoyl[3-(ethoxycarbonyl)-2-methyl-1-benzofuran-5-yl]sulfamoyl}benzoic acid
Compound characteristics
| Compound ID: | 7202-3020 |
| Compound Name: | 4-{butanoyl[3-(ethoxycarbonyl)-2-methyl-1-benzofuran-5-yl]sulfamoyl}benzoic acid |
| Molecular Weight: | 473.5 |
| Molecular Formula: | C23 H23 N O8 S |
| Smiles: | CCCC(N(c1ccc2c(c1)c(C(=O)OCC)c(C)o2)S(c1ccc(cc1)C(O)=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3449 |
| logD: | 1.2871 |
| logSw: | -4.2522 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 102.4 |
| InChI Key: | RHMQDKSMSYVYLX-UHFFFAOYSA-N |