5-Bromo-N-hydroxypicolinimidoyl Chloride - CAS 702680-55-5

Catalog:	BB034118
Product Name:	5-Bromo-N-hydroxypicolinimidoyl Chloride
CAS:	702680-55-5
Synonyms:	(2Z)-5-bromo-N-hydroxy-2-pyridinecarboximidoyl chloride; (2Z)-5-bromo-N-hydroxypyridine-2-carboximidoyl chloride

Technical Data

Patents

Computed Properties

IUPAC Name:	(2Z)-5-bromo-N-hydroxypyridine-2-carboximidoyl chloride
Description:	5-Bromo-N-hydroxypicolinimidoyl Chloride (CAS# 702680-55-5) is an intermediate in the synthesis of heterocyclic derivatives as antibacterial agents useful in treatment of bacterial infections.
Molecular Weight:	235.47
Molecular Formula:	C6H4BrClN2O
Canonical SMILES:	C1=CC(=NC=C1Br)C(=NO)Cl
InChI:	InChI=1S/C6H4BrClN2O/c7-4-1-2-5(9-3-4)6(8)10-11/h1-3,11H/b10-6-
InChI Key:	IDDNIGSLIWGZNV-POHAHGRESA-N

Publication Number	Title	Priority Date
EP-2625178-A1	Bacteria topoisomerase ii inhibiting 2-ethylcarbamoylamino-1, 3-benzothiazol-5-yls	20101008
US-2012088750-A1	Antibacterial compounds	20101008
US-9181234-B2	Antibacterial compounds	20101008
WO-2012045124-A1	Bacteria topoisomerase ii inhibiting 2-ethylcarbamoylamino-1, 3-benzothiazol-5-yls	20101008
US-2010069441-A1	Antimicrobial indoline compounds for treatment of bacterial infections	20080902

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Nitrogen Compounds

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[102388-00-1]
1-(Chloromethyl)-3-nitro-1H-pyrazole
[62838-59-9]
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[1281984-38-0]
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[1170836-25-5]
1-Cyclopentyl-5-nitro-1H-pyrazole

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Complexity:	165
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	1
Exact Mass:	233.91955
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	233.91955
Rotatable Bond Count:	1
Topological Polar Surface Area:	45.5
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.6