ethyl 2,5-dimethyl-4-[(4-sulfamoylphenyl)sulfamoyl]-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
ethyl 2,5-dimethyl-4-[(4-sulfamoylphenyl)sulfamoyl]-1H-pyrrole-3-carboxylate
ethyl 2,5-dimethyl-4-[(4-sulfamoylphenyl)sulfamoyl]-1H-pyrrole-3-carboxylate
Compound characteristics
Compound ID: | G070-0839 |
Compound Name: | ethyl 2,5-dimethyl-4-[(4-sulfamoylphenyl)sulfamoyl]-1H-pyrrole-3-carboxylate |
Molecular Weight: | 401.46 |
Molecular Formula: | C15 H19 N3 O6 S2 |
Smiles: | CCOC(c1c(c(C)[nH]c1C)S(Nc1ccc(cc1)S(N)(=O)=O)(=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 1.0202 |
logD: | 0.4571 |
logSw: | -2.0988 |
Hydrogen bond acceptors count: | 12 |
Hydrogen bond donors count: | 4 |
Polar surface area: | 123.033 |
InChI Key: | FJHRIXIPXAXRDX-UHFFFAOYSA-N |