methyl 4-{[3-(4-cyanoanilino)-3-oxopropyl]sulfamoyl}-1-methyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
methyl 4-{[3-(4-cyanoanilino)-3-oxopropyl]sulfamoyl}-1-methyl-1H-pyrrole-2-carboxylate
methyl 4-{[3-(4-cyanoanilino)-3-oxopropyl]sulfamoyl}-1-methyl-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | F065-4804 |
| Compound Name: | methyl 4-{[3-(4-cyanoanilino)-3-oxopropyl]sulfamoyl}-1-methyl-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 390.42 |
| Molecular Formula: | C17 H18 N4 O5 S |
| Smiles: | Cn1cc(cc1C(=O)OC)S(NCCC(Nc1ccc(C#N)cc1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.8235 |
| logD: | 0.8211 |
| logSw: | -2.3713 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 105.527 |
| InChI Key: | FEAVSEGOKNENFZ-UHFFFAOYSA-N |