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N-(2-fluorophenyl)-2-{N-[3-(trifluoromethyl)phenyl]-4-chlorobenzenesulfonamido}acetamide

N-(2-fluorophenyl)-2-{N-[3-(trifluoromethyl)phenyl]-4-chlorobenzenesulfonamido}acetamide

CAS: 337922-23-3

Formula: C21H15ClF4N2O3S

SMILES: FC1=C(NC(=O)CN(C2=CC(=CC=C2)C(F)(F)F)S(=O)(=O)C2=CC=C(Cl)C=C2)C=CC=C1

IUPAC: N-(2-fluorophenyl)-2-{N-[3-(trifluoromethyl)phenyl]-4-chlorobenzenesulfonamido}acetamide

InChI: InChI=1S/C21H15ClF4N2O3S/c22-15-8-10-17(11-9-15)32(30,31)28(16-5-3-4-14(12-16)21(24,25)26)13-20(29)27-19-7-2-1-6-18(19)23/h1-12H,13H2,(H,27,29)

Composition: C (51.81%), H (3.11%), Cl (7.28%), F (15.61%), N (5.75%), O (9.86%), S (6.58%)

Molar Mass: 486.87

Atom Count: 47

Heavy Atom Count: 32

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 486.0428039
Formal Charge 0
FSP3 0.1
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey NWRKZDXDLYJRAQ-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 113.14
Topological Polar Surface Area 66.48
Polarizability 42.45
Ring Count 3
Rotatable Bond Count 6

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Purity LeadTime CAS PacketSize UnitPrice
90% <2 Days 337922-23-3 $51.35-$86.31$51.35$63.37$86.31
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