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N'-[(E)-{5-bromo-2-[(2-cyanophenyl)methoxy]phenyl}methylidene]-4-cyano-2-fluorobenzohydrazide

N'-[(E)-{5-bromo-2-[(2-cyanophenyl)methoxy]phenyl}methylidene]-4-cyano-2-fluorobenzohydrazide

Formula: C23H14BrFN4O2

SMILES: FC1=CC(=CC=C1C(=O)NN=CC1=CC(Br)=CC=C1OCC1=CC=CC=C1C#N)C#N

IUPAC: N'-[(E)-{5-bromo-2-[(2-cyanophenyl)methoxy]phenyl}methylidene]-4-cyano-2-fluorobenzohydrazide

InChI: InChI=1S/C23H14BrFN4O2/c24-19-6-8-22(31-14-17-4-2-1-3-16(17)12-27)18(10-19)13-28-29-23(30)20-7-5-15(11-26)9-21(20)25/h1-10,13H,14H2,(H,29,30)/b28-13+

Composition: C (57.88%), H (2.96%), Br (16.74%), F (3.98%), N (11.74%), O (6.70%)

Molar Mass: 477.293

Atom Count: 45

Heavy Atom Count: 31

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 476.028417
Formal Charge 0
FSP3 0.04
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 5
Hydrogen Bond Donor Count 1
InChIKey HOTIRXHMAJVBGG-XODNFHPESA-N
Lipinski's Rule of Five
Molar Refractivity 118.59
Topological Polar Surface Area 98.27
Polarizability 43.57
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 C23H14BrFN4O2 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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