methyl 4-{[3-(2,4-difluoroanilino)-3-oxopropyl]sulfamoyl}-1-methyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
methyl 4-{[3-(2,4-difluoroanilino)-3-oxopropyl]sulfamoyl}-1-methyl-1H-pyrrole-2-carboxylate
methyl 4-{[3-(2,4-difluoroanilino)-3-oxopropyl]sulfamoyl}-1-methyl-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | F065-4720 |
| Compound Name: | methyl 4-{[3-(2,4-difluoroanilino)-3-oxopropyl]sulfamoyl}-1-methyl-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 401.39 |
| Molecular Formula: | C16 H17 F2 N3 O5 S |
| Smiles: | Cn1cc(cc1C(=O)OC)S(NCCC(Nc1ccc(cc1F)F)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.0849 |
| logD: | 1.0238 |
| logSw: | -2.4305 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 87.773 |
| InChI Key: | AIENJUJVZVLMFZ-UHFFFAOYSA-N |