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5-(3,4-dichlorophenyl)-N-(2,4-dimethoxyphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide

5-(3,4-dichlorophenyl)-N-(2,4-dimethoxyphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide

Formula: C22H15Cl2F3N4O3

SMILES: COC1=CC=C(NC(=O)C2=NN3C(=C2)N=C(C=C3C(F)(F)F)C2=CC=C(Cl)C(Cl)=C2)C(OC)=C1

IUPAC: 5-(3,4-dichlorophenyl)-N-(2,4-dimethoxyphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide

InChI: InChI=1S/C22H15Cl2F3N4O3/c1-33-12-4-6-15(18(8-12)34-2)29-21(32)17-10-20-28-16(11-3-5-13(23)14(24)7-11)9-19(22(25,26)27)31(20)30-17/h3-10H,1-2H3,(H,29,32)

Composition: C (51.68%), H (2.96%), Cl (13.87%), F (11.15%), N (10.96%), O (9.39%)

Molar Mass: 511.28

Atom Count: 49

Heavy Atom Count: 34

Properties
Properties
Common Names N/A
Aromatic Ring Count 4
Asymmetric Atom Count 0
Exact Mass 510.0473302
Formal Charge 0
FSP3 0.14
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 5
Hydrogen Bond Donor Count 1
InChIKey WKMJPHRBRJPDAE-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 132.09
Topological Polar Surface Area 77.75
Polarizability 45.95
Ring Count 4
Rotatable Bond Count 6

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C22H15Cl2F3N4O3 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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