6-Bromo-5-chloro-1H-indazole - CAS 1305208-02-9

Catalog:	BB007115
Product Name:	6-Bromo-5-chloro-1H-indazole
CAS:	1305208-02-9
Synonyms:	6-bromo-5-chloro-1H-indazole; 6-bromo-5-chloro-1H-indazole

Technical Data

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Computed Properties

IUPAC Name:	6-bromo-5-chloro-1H-indazole
Description:	6-Bromo-5-chloro-1H-indazole (CAS# 1305208-02-9) is a useful research chemical.
Molecular Weight:	231.48
Molecular Formula:	C7H4BrClN2
Canonical SMILES:	C1=C2C=NNC2=CC(=C1Cl)Br
InChI:	InChI=1S/C7H4BrClN2/c8-5-2-7-4(1-6(5)9)3-10-11-7/h1-3H,(H,10,11)
InChI Key:	RFOWTBQSXKQLNW-UHFFFAOYSA-N
LogP:	2.97880

Publication Number	Title	Priority Date
WO-2021067584-A1	Methods of treatment for alpha-1 antitrypsin deficiency	20191002
WO-2020247298-A2	1-pyrazolyl, 5-, 6- disubstituted indazole derivatives as lrrk2 inhibitors, pharmaceutical compositions, and uses thereof	20190606
WO-2020247160-A1	Condensed tryciclic pyrroles as alpha-1 antitrypsin modulators	20190514
WO-2020081257-A1	Modulators of alpha-1 antitrypsin	20181005
US-2020407372-A1	Polycyclic compounds as allosteric shp2 inhibitors	20171215

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Related Functional Groups

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GHS Hazard Statement:	H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	155
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	229.92464
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	229.92464
Rotatable Bond Count:	0
Topological Polar Surface Area:	28.7 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.9