ethyl 4-({2-[(2H-1,3-benzodioxol-5-yl)amino]-2-oxoethyl}sulfamoyl)-2,5-dimethyl-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
ethyl 4-({2-[(2H-1,3-benzodioxol-5-yl)amino]-2-oxoethyl}sulfamoyl)-2,5-dimethyl-1H-pyrrole-3-carboxylate
ethyl 4-({2-[(2H-1,3-benzodioxol-5-yl)amino]-2-oxoethyl}sulfamoyl)-2,5-dimethyl-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | G070-1631 |
| Compound Name: | ethyl 4-({2-[(2H-1,3-benzodioxol-5-yl)amino]-2-oxoethyl}sulfamoyl)-2,5-dimethyl-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 423.44 |
| Molecular Formula: | C18 H21 N3 O7 S |
| Smiles: | CCOC(c1c(c(C)[nH]c1C)S(NCC(Nc1ccc2c(c1)OCO2)=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6718 |
| logD: | 1.6698 |
| logSw: | -2.6088 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 113.803 |
| InChI Key: | XUXOSFBAPIPUJX-UHFFFAOYSA-N |