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2-(2-{[3-methyl-4-(pyrrolidin-1-yl)phenyl]methyl}diazen-1-yl)-5-nitropyridine

2-(2-{[3-methyl-4-(pyrrolidin-1-yl)phenyl]methyl}diazen-1-yl)-5-nitropyridine

Formula: C17H19N5O2

SMILES: CC1=CC(CN=NC2=CC=C(C=N2)[N+]([O-])=O)=CC=C1N1CCCC1

IUPAC: 2-(2-{[3-methyl-4-(pyrrolidin-1-yl)phenyl]methyl}diazen-1-yl)-5-nitropyridine

InChI: InChI=1S/C17H19N5O2/c1-13-10-14(4-6-16(13)21-8-2-3-9-21)11-19-20-17-7-5-15(12-18-17)22(23)24/h4-7,10,12H,2-3,8-9,11H2,1H3

Composition: C (62.75%), H (5.89%), N (21.52%), O (9.83%)

Molar Mass: 325.372

Atom Count: 43

Heavy Atom Count: 24

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 325.153874872
Formal Charge 0
FSP3 0.35
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 6
Hydrogen Bond Donor Count 0
InChIKey JKPPZPWKCXIYOU-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 94.69
Topological Polar Surface Area 83.99
Polarizability 33.95
Ring Count 3
Rotatable Bond Count 5

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C17H19N5O2 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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