ethyl 4-({2-[(6-methoxy-1,3-benzothiazol-2-yl)amino]-2-oxoethyl}sulfamoyl)-2,5-dimethyl-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
ethyl 4-({2-[(6-methoxy-1,3-benzothiazol-2-yl)amino]-2-oxoethyl}sulfamoyl)-2,5-dimethyl-1H-pyrrole-3-carboxylate
ethyl 4-({2-[(6-methoxy-1,3-benzothiazol-2-yl)amino]-2-oxoethyl}sulfamoyl)-2,5-dimethyl-1H-pyrrole-3-carboxylate
Compound characteristics
Compound ID: | G070-0639 |
Compound Name: | ethyl 4-({2-[(6-methoxy-1,3-benzothiazol-2-yl)amino]-2-oxoethyl}sulfamoyl)-2,5-dimethyl-1H-pyrrole-3-carboxylate |
Molecular Weight: | 466.53 |
Molecular Formula: | C19 H22 N4 O6 S2 |
Smiles: | CCOC(c1c(c(C)[nH]c1C)S(NCC(Nc1nc2ccc(cc2s1)OC)=O)(=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 2.665 |
logD: | 2.6501 |
logSw: | -3.23 |
Hydrogen bond acceptors count: | 12 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 113.993 |
InChI Key: | JJYOQNMWJWJUAC-UHFFFAOYSA-N |