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N2,N5-bis[2-(trifluoromethyl)phenyl]pyridine-2,5-dicarboxamide

N2,N5-bis[2-(trifluoromethyl)phenyl]pyridine-2,5-dicarboxamide

Formula: C21H13F6N3O2

SMILES: FC(F)(F)C1=CC=CC=C1NC(=O)C1=CC=C(N=C1)C(=O)NC1=CC=CC=C1C(F)(F)F

IUPAC: N2,N5-bis[2-(trifluoromethyl)phenyl]pyridine-2,5-dicarboxamide

InChI: InChI=1S/C21H13F6N3O2/c22-20(23,24)13-5-1-3-7-15(13)29-18(31)12-9-10-17(28-11-12)19(32)30-16-8-4-2-6-14(16)21(25,26)27/h1-11H,(H,29,31)(H,30,32)

Composition: C (55.64%), H (2.89%), F (25.14%), N (9.27%), O (7.06%)

Molar Mass: 453.344

Atom Count: 45

Heavy Atom Count: 32

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 453.091195649
Formal Charge 0
FSP3 0.1
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 2
InChIKey PJBGGOAPDCKEOH-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 106.54
Topological Polar Surface Area 71.09
Polarizability 37.07
Ring Count 3
Rotatable Bond Count 6

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Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C21H13F6N3O2 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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