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N'-({4-[(2-chloro-6-fluorophenyl)methoxy]phenyl}methylidene)-3-(2,5-dimethylphenyl)prop-2-enehydrazide

N'-({4-[(2-chloro-6-fluorophenyl)methoxy]phenyl}methylidene)-3-(2,5-dimethylphenyl)prop-2-enehydrazide

CAS: 677749-46-1

Formula: C25H22ClFN2O2

SMILES: CC1=CC(C=CC(=O)NN=CC2=CC=C(OCC3=C(Cl)C=CC=C3F)C=C2)=C(C)C=C1

IUPAC: N'-({4-[(2-chloro-6-fluorophenyl)methoxy]phenyl}methylidene)-3-(2,5-dimethylphenyl)prop-2-enehydrazide

InChI: InChI=1S/C25H22ClFN2O2/c1-17-6-7-18(2)20(14-17)10-13-25(30)29-28-15-19-8-11-21(12-9-19)31-16-22-23(26)4-3-5-24(22)27/h3-15H,16H2,1-2H3,(H,29,30)

Composition: C (68.73%), H (5.08%), Cl (8.11%), F (4.35%), N (6.41%), O (7.32%)

Molar Mass: 436.91

Atom Count: 53

Heavy Atom Count: 31

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 436.1353838
Formal Charge 0
FSP3 0.12
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey QCUNCZWDCZUIRX-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 124.16
Topological Polar Surface Area 50.69
Polarizability 46.13
Ring Count 3
Rotatable Bond Count 7

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Purity LeadTime CAS PacketSize UnitPrice
90% <2 Days 677749-46-1 $51.35-$86.31$51.35$63.37$86.31
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