AG00BYHG

372196-67-3 | 2-Methyl-5-nitro-1-benzenesulfonic acid 2-[(6-bromoimidazo[1,2-a]pyridin-3-yl)methylene]-1-methylhydrazide

AG00BYHG

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CAS Number	372196-67-3
Catalog Number	AG00BYHG(AGN-PC-0BL87X)
Chemical Name	2-Methyl-5-nitro-1-benzenesulfonic acid 2-[(6-bromoimidazo[1,2-a]pyridin-3-yl)methylene]-1-methylhydrazide
IUPAC Name	N-[(E)-(6-bromoimidazo[1,2-a]pyridin-3-yl)methylideneamino]-N,2-dimethyl-5-nitrobenzenesulfonamide
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+
InChI Key	QTHCAAFKVUWAFI-DJKKODMXSA-N
MDL Number	MFCD12407411
Molecular Formula	C16H14BrN5O4S
Molecular Weight	452.2825
SMILES	O=S(C1=CC([N+]([O-])=O)=CC=C1C)(N(C)/N=C/C2=CN=C3C=CC(Br)=CN32)=O
UNII	9058I8S63D
Synonyms	PIK 75, PIK-75, PIK-75, 372196-67-3, PIK 75, UNII-9058I8S63D, 945619-31-8, CHEMBL393525, 9058I8S63D, (E)-N'-((6-bromoimidazo[1,2-a]pyridin-3-yl)methylene)-N,2-dimethyl-5-nitrobenzenesulfonohydrazide, J-502643, PIK 75 hydrochloride, EC-000.2124, (Z)-N'-((6-bromoimidazo[1,2-a]pyridin-3-yl)methylene)-N,2-dimethyl-5-nitrobenzenesulfonohydrazide, N'-[(1E)-(6-bromoimidazo[1,2-a]pyridin-3-yl)methylene]-N,2-dimethyl-5-nitrobenzenesulfonohydrazide hydrochloride, imidazopyridine derivative, 8c, SCHEMBL6219739, SCHEMBL12700767, BDBM25036, CHEBI:94827, SYN1067, N'-((6-bromoimidazo[1,2-a]pyridin-3-yl)methylene)-N,2-dimethyl-5-nitrobenzenesulfonohydrazide, N-[(E)-(6-Bromoimidazo[1,2-a]pyridin-3-yl)methylideneamino]-N,2-dimethyl-5-nitrobenzenesulfonamide, ABP000096, PIK-75, 1, ZINC72232757, AKOS016013588, SB19246, NCGC00346500-05, 2-Methyl-5-nitro-1-benzenesulfonic acid 2-[(6-bromoimidazo[1,2-a]pyridin-3-yl)methylene]-1-methylhydrazide, AS-16223, Benzenesulfonic acid, 2-methyl-5-nitro-, 2-((6-bromoimidazo(1,2-a)pyridin-3-yl)methylene)-1-methylhydrazide, AX8249527, RT-015054, CU-00000000277-1, BRD-K49371609-003-01-2, N''-[(1E)-{6-bromoimidazo[1,2-a]pyridin-3-yl}methylidene]-N,2-dimethyl-5-nitrobenzene-1-sulfonohydrazide, cis PIK-75, PIK75, D00HSJ, C16H14BrN5O4S, CID 9825070, CID10275789, A2080, C549211, imidazopyridine derivative 8c [PMID 17601739], ~{N}-[(~{E})-(6-bromanylimidazo[1,2-a]pyridin-3-yl)methylideneamino]-~{N},2-dimethyl-5-nitro-benzenesulfonamide, 372196-77-5,

Complexity	679
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	1
Exact Mass	450.995g/mol
Formal Charge	0
Heavy Atom Count	27
Hydrogen Bond Acceptor Count	7
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	452.283g/mol
Monoisotopic Mass	450.995g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	121A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.8

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	\N
Hazard statements	H315-H319-H335-H302+H312+H332
Packing Group	\N
Precautionary statements	P301+P312-P302+P352
UN Code	\N

Certificate of Analysis

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