ethyl 4-[{2-[(2,3-dihydro-1,4-benzodioxin-6-yl)amino]-2-oxoethyl}(methyl)sulfamoyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
ethyl 4-[{2-[(2,3-dihydro-1,4-benzodioxin-6-yl)amino]-2-oxoethyl}(methyl)sulfamoyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate
ethyl 4-[{2-[(2,3-dihydro-1,4-benzodioxin-6-yl)amino]-2-oxoethyl}(methyl)sulfamoyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | G070-1832 |
| Compound Name: | ethyl 4-[{2-[(2,3-dihydro-1,4-benzodioxin-6-yl)amino]-2-oxoethyl}(methyl)sulfamoyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 451.5 |
| Molecular Formula: | C20 H25 N3 O7 S |
| Smiles: | CCOC(c1c(c(C)[nH]c1C)S(N(C)CC(Nc1ccc2c(c1)OCCO2)=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.1368 |
| logD: | 1.1364 |
| logSw: | -2.5691 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 103.317 |
| InChI Key: | WJWBTWYUZCNABJ-UHFFFAOYSA-N |