methyl 1-methyl-4-{[3-(methylsulfanyl)phenyl]sulfamoyl}-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
methyl 1-methyl-4-{[3-(methylsulfanyl)phenyl]sulfamoyl}-1H-pyrrole-2-carboxylate
methyl 1-methyl-4-{[3-(methylsulfanyl)phenyl]sulfamoyl}-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | E138-1038 |
| Compound Name: | methyl 1-methyl-4-{[3-(methylsulfanyl)phenyl]sulfamoyl}-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 340.42 |
| Molecular Formula: | C14 H16 N2 O4 S2 |
| Smiles: | Cn1cc(cc1C(=O)OC)S(Nc1cccc(c1)SC)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.044 |
| logD: | 2.0422 |
| logSw: | -2.8337 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.372 |
| InChI Key: | KLKULPQIUKYUSK-UHFFFAOYSA-N |