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2-(2,4-dichlorophenoxy)-N-{4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl}acetamide

2-(2,4-dichlorophenoxy)-N-{4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl}acetamide

Formula: C20H18Cl2N4O4S

SMILES: CC1=CC(C)=NC(NS(=O)(=O)C2=CC=C(NC(=O)COC3=CC=C(Cl)C=C3Cl)C=C2)=N1

IUPAC: 2-(2,4-dichlorophenoxy)-N-{4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl}acetamide

InChI: InChI=1S/C20H18Cl2N4O4S/c1-12-9-13(2)24-20(23-12)26-31(28,29)16-6-4-15(5-7-16)25-19(27)11-30-18-8-3-14(21)10-17(18)22/h3-10H,11H2,1-2H3,(H,25,27)(H,23,24,26)

Composition: C (49.91%), H (3.77%), Cl (14.73%), N (11.64%), O (13.30%), S (6.66%)

Molar Mass: 481.35

Atom Count: 49

Heavy Atom Count: 31

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 480.0425816
Formal Charge 0
FSP3 0.15
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 6
Hydrogen Bond Donor Count 2
InChIKey XXFILKYDGXQKLZ-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 119.12
Topological Polar Surface Area 110.28
Polarizability 45.97
Ring Count 3
Rotatable Bond Count 6

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C20H18Cl2N4O4S $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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