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2-{2-[(1-{[1,1'-biphenyl]-4-yl}-2,5-dimethylpyrrol-3-yl)methyl]diazen-1-yl}-5-nitropyridine

2-{2-[(1-{[1,1'-biphenyl]-4-yl}-2,5-dimethylpyrrol-3-yl)methyl]diazen-1-yl}-5-nitropyridine

Formula: C24H21N5O2

SMILES: CC1=CC(CN=NC2=CC=C(C=N2)[N+]([O-])=O)=C(C)N1C1=CC=C(C=C1)C1=CC=CC=C1

IUPAC: 2-{2-[(1-{[1,1'-biphenyl]-4-yl}-2,5-dimethyl-1H-pyrrol-3-yl)methyl]diazen-1-yl}-5-nitropyridine

InChI: InChI=1S/C24H21N5O2/c1-17-14-21(15-26-27-24-13-12-23(16-25-24)29(30)31)18(2)28(17)22-10-8-20(9-11-22)19-6-4-3-5-7-19/h3-14,16H,15H2,1-2H3

Composition: C (70.06%), H (5.14%), N (17.02%), O (7.78%)

Molar Mass: 411.465

Atom Count: 52

Heavy Atom Count: 31

Properties
Properties
Common Names N/A
Aromatic Ring Count 4
Asymmetric Atom Count 0
Exact Mass 411.169524936
Formal Charge 0
FSP3 0.12
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 5
Hydrogen Bond Donor Count 0
InChIKey JICNHGMOPCTFON-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 132.86
Topological Polar Surface Area 85.68
Polarizability 46.86
Ring Count 4
Rotatable Bond Count 6

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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 C24H21N5O2 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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