ethyl 5-({[(2H-1,3-benzodioxol-5-yl)methyl](1-methyl-1H-imidazole-4-sulfonyl)amino}methyl)-2,4-dimethyl-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
ethyl 5-({[(2H-1,3-benzodioxol-5-yl)methyl](1-methyl-1H-imidazole-4-sulfonyl)amino}methyl)-2,4-dimethyl-1H-pyrrole-3-carboxylate
ethyl 5-({[(2H-1,3-benzodioxol-5-yl)methyl](1-methyl-1H-imidazole-4-sulfonyl)amino}methyl)-2,4-dimethyl-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | F348-0467 |
| Compound Name: | ethyl 5-({[(2H-1,3-benzodioxol-5-yl)methyl](1-methyl-1H-imidazole-4-sulfonyl)amino}methyl)-2,4-dimethyl-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 474.53 |
| Molecular Formula: | C22 H26 N4 O6 S |
| Smiles: | CCOC(c1c(C)c(CN(Cc2ccc3c(c2)OCO3)S(c2cn(C)cn2)(=O)=O)[nH]c1C)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3351 |
| logD: | 2.3351 |
| logSw: | -2.9349 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 93.099 |
| InChI Key: | XPCXGYSOPVRTJH-UHFFFAOYSA-N |