AC1NR04X
4-(2-chloroanilino)-N-[4-[(2,6-dimethoxypyrimidin-4-yl)sulfamoyl]phenyl]-3,5-dinitrobenzamide
Also Known As: 4-(2-Chloroanilino)-N-{4-[(2,6-dimethoxypyrimidin-4-yl)sulfamoyl]phenyl}-3,5-dinitrobenzamide|4-(2-chloroanilino)-N-[4-[(2,6-dimethoxypyrimidin-4-yl)sulfamoyl]phenyl]-3,5-dinitrobenzamide
CAS: 7006-79-3
| Molecular Formula | C25H20ClN7O9S |
|---|---|
| Molecular Weight | 629.0732 g/mol |
| LogP | 4.7603 |
| Topological Polar Surface Area | 217.82 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 11 |
| Exact Mass | 629.0732 |
| Monoisotopic Mass | 629.0732 |
| Heavy Atoms | 43 |
| Complexity | 1780.2697 |
Chemical Identifiers
| CAS Number | 7006-79-3 |
|---|---|
| SMILES | COC1=NC(=NC(=C1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC(=C(C(=C3)[N+](=O)[O-])NC4=CC=CC=C4Cl)[N+](=O)[O-])OC |
Product Overview
AC1NR04X (CAS 7006-79-3), with molecular formula C25H20ClN7O9S and molecular weight 629.0732 g/mol. IUPAC: 4-(2-chloroanilino)-N-[4-[(2,6-dimethoxypyrimidin-4-yl)sulfamoyl]phenyl]-3,5-dinitrobenzamide.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
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