4-Bromo-1H-indazole-6-carboxylic Acid - CAS 885523-43-3

Catalog:	BB038999
Product Name:	4-Bromo-1H-indazole-6-carboxylic Acid
CAS:	885523-43-3
Synonyms:	4-bromo-1H-indazole-6-carboxylic acid; 4-bromo-1H-indazole-6-carboxylic acid

Technical Data

Patents

Computed Properties

IUPAC Name:	4-bromo-1H-indazole-6-carboxylic acid
Description:	4-Bromo-1H-indazole-6-carboxylic Acid (CAS# 885523-43-3) is a useful research chemical.
Molecular Weight:	241.04
Molecular Formula:	C8H5BrN2O2
Canonical SMILES:	C1=C(C=C(C2=C1NN=C2)Br)C(=O)O
InChI:	InChI=1S/C8H5BrN2O2/c9-6-1-4(8(12)13)2-7-5(6)3-10-11-7/h1-3H,(H,10,11)(H,12,13)
InChI Key:	PTPANGLJLZZYNH-UHFFFAOYSA-N
MDL:	MFCD07781800
LogP:	2.02360

Publication Number	Title	Priority Date
CN-110845474-A	Target I-type PRMT compound and preparation method and application thereof	20191107
CN-110845474-B	Target I-type PRMT compound and preparation method and application thereof	20191107
WO-2021088885-A1	Compound targeting type i prmt, preparation method therefor, and application thereof	20191107
WO-2020192562-A1	Substituted heterocyclic amide compound and preparation method therefor and pharmaceutical use thereof	20190322
CN-113508109-A	Substituted heterocyclic amide compound, preparation method and medical application thereof	20190322

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Complexity:	224
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	239.95344
Formal Charge:	0
Heavy Atom Count:	13
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	239.95344
Rotatable Bond Count:	1
Topological Polar Surface Area:	66
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.8