ethyl 1-methyl-4-(2-{[3-(methylsulfanyl)phenyl]carbamoyl}pyrrolidine-1-sulfonyl)-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
ethyl 1-methyl-4-(2-{[3-(methylsulfanyl)phenyl]carbamoyl}pyrrolidine-1-sulfonyl)-1H-pyrrole-2-carboxylate
ethyl 1-methyl-4-(2-{[3-(methylsulfanyl)phenyl]carbamoyl}pyrrolidine-1-sulfonyl)-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | F065-0520 |
| Compound Name: | ethyl 1-methyl-4-(2-{[3-(methylsulfanyl)phenyl]carbamoyl}pyrrolidine-1-sulfonyl)-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 451.56 |
| Molecular Formula: | C20 H25 N3 O5 S2 |
| Smiles: | CCOC(c1cc(cn1C)S(N1CCCC1C(Nc1cccc(c1)SC)=O)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.1493 |
| logD: | 2.1492 |
| logSw: | -2.823 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.941 |
| InChI Key: | HRCUWJXZPQNJAC-KRWDZBQOSA-N |