ethyl 2,5-dimethyl-4-({2-[4-(methylsulfanyl)phenyl]ethyl}sulfamoyl)-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
ethyl 2,5-dimethyl-4-({2-[4-(methylsulfanyl)phenyl]ethyl}sulfamoyl)-1H-pyrrole-3-carboxylate
ethyl 2,5-dimethyl-4-({2-[4-(methylsulfanyl)phenyl]ethyl}sulfamoyl)-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | G070-0945 |
| Compound Name: | ethyl 2,5-dimethyl-4-({2-[4-(methylsulfanyl)phenyl]ethyl}sulfamoyl)-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 396.53 |
| Molecular Formula: | C18 H24 N2 O4 S2 |
| Smiles: | CCOC(c1c(c(C)[nH]c1C)S(NCCc1ccc(cc1)SC)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2593 |
| logD: | 3.2591 |
| logSw: | -3.574 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.38 |
| InChI Key: | AZLSCPOJWPMHIX-UHFFFAOYSA-N |