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N'-[(E)-{6-bromoimidazo[1,2-a]pyridin-3-yl}methylidene]-N,2-dimethyl-5-nitrobenzenesulfonohydrazide

N'-[(E)-{6-bromoimidazo[1,2-a]pyridin-3-yl}methylidene]-N,2-dimethyl-5-nitrobenzenesulfonohydrazide

CAS: 372196-67-3

Formula: C16H14BrN5O4S

SMILES: CN(N=CC1=CN=C2C=CC(Br)=CN12)S(=O)(=O)C1=C(C)C=CC(=C1)[N+]([O-])=O

IUPAC: N'-[(E)-{6-bromoimidazo[1,2-a]pyridin-3-yl}methylidene]-N,2-dimethyl-5-nitrobenzene-1-sulfonohydrazide

InChI: InChI=1S/C16H14BrN5O4S/c1-11-3-5-13(22(23)24)7-15(11)27(25,26)20(2)19-9-14-8-18-16-6-4-12(17)10-21(14)16/h3-10H,1-2H3/b19-9+

Composition: C (42.49%), H (3.12%), Br (17.67%), N (15.48%), O (14.15%), S (7.09%)

Molar Mass: 452.28

Atom Count: 41

Heavy Atom Count: 27

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 450.994988
Formal Charge 0
FSP3 0.12
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 6
Hydrogen Bond Donor Count 0
InChIKey QTHCAAFKVUWAFI-DJKKODMXSA-N
Lipinski's Rule of Five 1
Molar Refractivity 104.95
Topological Polar Surface Area 110.18
Polarizability 39.18
Ring Count 3
Rotatable Bond Count 4

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Purity LeadTime CAS PacketSize UnitPrice
98% <4 Days 372196-67-3 $30.58-$496.10$30.58$39.75$86.38$152.88$275.18$496.10
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