4-Cyano-7-azaindole - CAS 344327-11-3

Catalog:	BB022134
Product Name:	4-Cyano-7-azaindole
CAS:	344327-11-3
Synonyms:	7-Azaindole-4-carbonitrile

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	1H-Pyrrolo(2,3-b)pyridine-4-carbonitrile
Description:	4-Cyano-7-azaindole (CAS# 344327-11-3) is a useful research chemical.
Molecular Weight:	143.15
Molecular Formula:	C8H5N3
Canonical SMILES:	C1=CNC2=NC=CC(=C21)C#N
InChI:	InChI=1S/C8H5N3/c9-5-6-1-3-10-8-7(6)2-4-11-8/h1-4H,(H,10,11)
InChI Key:	HAROKQXDLYCEQV-UHFFFAOYSA-N
Purity:	97.0 %
Density:	1.29 g/cm³
Appearance:	Solid
MDL:	MFCD08272235
LogP:	1.43458

Publication Number	Title	Priority Date
WO-2021032148-A1	Aminopyrazine compounds as hpk1 inhibitor and the use thereof	20190821
WO-2021012049-A1	Substituted 2-morpholinopyridine derivatives as atr kinase inhibitors	20190722
WO-2020087170-A1	Compounds, pharmaceutical compositions, and methods of preparing compounds and of their use as atr kinase inhibitors	20181030
EP-3873905-A1	Compounds, pharmaceutical compositions, and methods of preparing compounds and of their use as atr kinase inhibitors	20181030
KR-20210097124-A	Compounds, pharmaceutical compositions, and methods of making compounds and methods of using them as ATR kinase inhibitors	20181030

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Related Functional Groups

Azaindoles

[1190318-85-4]
3-Iodo-7-methoxy-4-azaindole
[55052-28-3]
4-Chloro-7-azaindole
[1021339-19-4]
6-Chloro-4-azaindole
[1190309-76-2]
4-Fluoro-5-azaindole
[1215387-58-8]
5-Bromo-6-azaindole
[143141-23-5]
1-(Phenylsulfonyl)-7-azaindole

Indoles

[2170450-99-2]
4-Methyl-1-(phenylsulfonyl)-1H-indole-2-carbonitrile
[20776-45-8]
5-Benzyloxytryptamine
[467458-46-4]
Ethyl 3-formyl-1H-indole-5-carboxylate
[927181-98-4]
Ethyl 3-formyl-1H-indole-7-carboxylate
[61149-52-8]
Ethyl 4-methyl-7-nitro-1H-indole-2-carboxylate
[84639-06-5]
Ethyl 7-(benzyloxy)-1H-indole-2-carboxylate

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GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P310, P312, P321, P330, P332+P313, P362, P403+P233, P405, and P501
Signal Word:	Danger

Complexity:	193
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	143.048347172
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	143.048347172
Rotatable Bond Count:	0
Topological Polar Surface Area:	52.5 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1