ethyl 4-[(2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-2-oxoethyl)sulfamoyl]-1,2,5-trimethyl-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
ethyl 4-[(2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-2-oxoethyl)sulfamoyl]-1,2,5-trimethyl-1H-pyrrole-3-carboxylate
ethyl 4-[(2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-2-oxoethyl)sulfamoyl]-1,2,5-trimethyl-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | G937-2826 |
| Compound Name: | ethyl 4-[(2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-2-oxoethyl)sulfamoyl]-1,2,5-trimethyl-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 451.5 |
| Molecular Formula: | C20 H25 N3 O7 S |
| Smiles: | CCOC(c1c(c(C)n(C)c1C)S(NCC(NCc1ccc2c(c1)OCO2)=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.2417 |
| logD: | 1.2366 |
| logSw: | -2.5586 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 107.116 |
| InChI Key: | XKFIYJUVYBWYQC-UHFFFAOYSA-N |