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3-(3-chlorophenyl)-1-(4-{[3-(trifluoromethyl)phenyl]sulfamoyl}phenyl)urea

3-(3-chlorophenyl)-1-(4-{[3-(trifluoromethyl)phenyl]sulfamoyl}phenyl)urea

Formula: C20H15ClF3N3O3S

SMILES: FC(F)(F)C1=CC(NS(=O)(=O)C2=CC=C(NC(=O)NC3=CC=CC(Cl)=C3)C=C2)=CC=C1

IUPAC: 3-(3-chlorophenyl)-1-(4-{[3-(trifluoromethyl)phenyl]sulfamoyl}phenyl)urea

InChI: InChI=1S/C20H15ClF3N3O3S/c21-14-4-2-5-16(12-14)26-19(28)25-15-7-9-18(10-8-15)31(29,30)27-17-6-1-3-13(11-17)20(22,23)24/h1-12,27H,(H2,25,26,28)

Composition: C (51.13%), H (3.22%), Cl (7.54%), F (12.13%), N (8.94%), O (10.22%), S (6.82%)

Molar Mass: 469.86

Atom Count: 46

Heavy Atom Count: 31

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 469.0474747
Formal Charge 0
FSP3 0.05
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 3
InChIKey REKQVTLWXUPXSV-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 113.66
Topological Polar Surface Area 87.3
Polarizability 42
Ring Count 3
Rotatable Bond Count 5

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C20H15ClF3N3O3S $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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