ethyl 4-{[2-(4-bromo-3-methylanilino)-2-oxoethyl](methyl)sulfamoyl}-1-methyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
ethyl 4-{[2-(4-bromo-3-methylanilino)-2-oxoethyl](methyl)sulfamoyl}-1-methyl-1H-pyrrole-2-carboxylate
ethyl 4-{[2-(4-bromo-3-methylanilino)-2-oxoethyl](methyl)sulfamoyl}-1-methyl-1H-pyrrole-2-carboxylate
Compound characteristics
Compound ID: | F065-4415 |
Compound Name: | ethyl 4-{[2-(4-bromo-3-methylanilino)-2-oxoethyl](methyl)sulfamoyl}-1-methyl-1H-pyrrole-2-carboxylate |
Molecular Weight: | 472.36 |
Molecular Formula: | C18 H22 Br N3 O5 S |
Smiles: | CCOC(c1cc(cn1C)S(N(C)CC(Nc1ccc(c(C)c1)[Br])=O)(=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 2.9007 |
logD: | 2.9 |
logSw: | -3.1737 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 79.016 |
InChI Key: | XJIKZWJDKPPSQY-UHFFFAOYSA-N |