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N-[4-chloro-3-(trifluoromethyl)phenyl]-1-{N'-[(E)-1H-indol-3-ylmethylidene]hydrazinecarbonyl}formamide

N-[4-chloro-3-(trifluoromethyl)phenyl]-1-{N'-[(E)-1H-indol-3-ylmethylidene]hydrazinecarbonyl}formamide

Formula: C18H12ClF3N4O2

SMILES: FC(F)(F)C1=CC(NC(=O)C(=O)NN=CC2=CNC3=CC=CC=C23)=CC=C1Cl

IUPAC: N-[4-chloro-3-(trifluoromethyl)phenyl]-1-{N'-[(E)-(1H-indol-3-yl)methylidene]hydrazinecarbonyl}formamide

InChI: InChI=1S/C18H12ClF3N4O2/c19-14-6-5-11(7-13(14)18(20,21)22)25-16(27)17(28)26-24-9-10-8-23-15-4-2-1-3-12(10)15/h1-9,23H,(H,25,27)(H,26,28)/b24-9+

Composition: C (52.89%), H (2.96%), Cl (8.67%), F (13.94%), N (13.71%), O (7.83%)

Molar Mass: 408.77

Atom Count: 40

Heavy Atom Count: 28

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 408.0600878
Formal Charge 0
FSP3 0.06
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 3
InChIKey ZZZYBIGPDJLBDD-PGGKNCGUSA-N
Lipinski's Rule of Five 1
Molar Refractivity 99.5
Topological Polar Surface Area 86.35
Polarizability 36.77
Ring Count 3
Rotatable Bond Count 5

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Purity (%)
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Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C18H12ClF3N4O2 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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