ethyl 4-[(4-bromo-3-methylphenyl)sulfamoyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
ethyl 4-[(4-bromo-3-methylphenyl)sulfamoyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate
ethyl 4-[(4-bromo-3-methylphenyl)sulfamoyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | E912-0955 |
| Compound Name: | ethyl 4-[(4-bromo-3-methylphenyl)sulfamoyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 415.3 |
| Molecular Formula: | C16 H19 Br N2 O4 S |
| Smiles: | CCOC(c1c(c(C)[nH]c1C)S(Nc1ccc(c(C)c1)[Br])(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8011 |
| logD: | 3.6559 |
| logSw: | -4.0917 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.43 |
| InChI Key: | ROHJBYMGHTVOFI-UHFFFAOYSA-N |