5-Chloro-3-iodo-1H-pyrazolo[3,4-c]pyridine - CAS 1260666-29-2

Catalog:	BB006327
Product Name:	5-Chloro-3-iodo-1H-pyrazolo[3,4-c]pyridine
CAS:	1260666-29-2
Synonyms:	5-chloro-3-iodo-2H-pyrazolo[3,4-c]pyridine

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Computed Properties

IUPAC Name:	5-chloro-3-iodo-2H-pyrazolo[3,4-c]pyridine
Description:	5-Chloro-3-iodo-1H-pyrazolo[3,4-c]pyridine (CAS# 1260666-29-2) is a useful research chemical.
Molecular Weight:	279.47
Molecular Formula:	C6H3ClIN3
Canonical SMILES:	C1=C(N=CC2=NNC(=C21)I)Cl
InChI:	InChI=1S/C6H3ClIN3/c7-5-1-3-4(2-9-5)10-11-6(3)8/h1-2H,(H,10,11)
InChI Key:	KAGKORFWYBVTEW-UHFFFAOYSA-N
LogP:	2.21590

Publication Number	Title	Priority Date
WO-2021126804-A1	Indazole derivatives and methods of use thereof for the treatment of herpes viruses	20191218
WO-2021007477-A1	Indazoles and azaindazoles as lrrk2 inhibitors	20190711
EP-3672973-A1	Heterocyclic compounds as kinase inhibitors, compositions comprising the heterocyclic compound, and methods of use thereof	20170822
WO-2019037640-A1	HETEROCYCLIC COMPOUNDS AS KINASE INHIBITORS, COMPOSITIONS COMPRISING THE HETEROCYCLIC COMPOUND, AND METHODS OF USING THE SAME	20170822
US-2020239438-A1	Heterocyclic compounds as kinase inhibitors, compositions comprising the heterocyclic compound, and methods of use thereof	20170822

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GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P264, P270, P301+P312, P330, and P501
Signal Word:	Warning

Complexity:	157
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	278.90602
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	278.90602
Rotatable Bond Count:	0
Topological Polar Surface Area:	41.6 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.1