5-Cyano-7-azaindole - CAS 517918-95-5

Catalog:	BB027593
Product Name:	5-Cyano-7-azaindole
CAS:	517918-95-5
Synonyms:	1H-pyrrolo[2,3-b]pyridine-5-carbonitrile; 1H-pyrrolo[2,3-b]pyridine-5-carbonitrile

Technical Data

Patents

Literatures

Computed Properties

IUPAC Name:	1H-pyrrolo[2,3-b]pyridine-5-carbonitrile
Description:	5-Cyano-7-azaindole (CAS# 517918-95-5) is a useful research chemical.
Molecular Weight:	143.15
Molecular Formula:	C8H5N3
Canonical SMILES:	C1=CNC2=C1C=C(C=N2)C#N
InChI:	InChI=1S/C8H5N3/c9-4-6-3-7-1-2-10-8(7)11-5-6/h1-3,5H,(H,10,11)
InChI Key:	DRAQIXNADYAISI-UHFFFAOYSA-N
Density:	1.34 g/cm³
Solubility:	Insoluble in water
Appearance:	Powder
MDL:	MFCD06659684
LogP:	1.43458

Publication Number	Title	Priority Date
US-2021171531-A1	Masp-2 inhibitors and methods of use	20191204
WO-2021113682-A1	Masp-2 inhibitors and methods of use	20191204
CN-112759541-A	Indole-like derivatives and uses thereof	20191021
WO-2020216378-A1	Heterocyclic compound, application thereof, and composition containing same	20190426
WO-2020182159-A1	Jak kinase inhibitor, preparation method for same, and applications thereof in field of medicine	20190314

PMID	Publication Date	Title	Journal
20590157	20100729	Excited state charge transfer coupled double proton transfer reaction of 7-azaindole derivatives in methanol: a theoretical study	The journal of physical chemistry. A
18821540	20081024	Cyano analogues of 7-azaindole: probing excited-state charge-coupled proton transfer reactions in protic solvents	Chemphyschem : a European journal of chemical physics and physical chemistry

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Related Functional Groups

Nitrogen Compounds

[89908-23-6]
2-Propenoic acid, 2-(3',3'-dimethyl-6-nitrospiro[2H-1-benzopyran-2,2'-[2H]indol]-1'(3'H)-yl)ethyl ester
[1383427-98-2]
(S)-Hexahydropyrazino[2,1-c][1,4]oxazin-4(3H)-one hydrochloride
[618-40-6]
1-Methyl-1-phenylhydrazine
[2006278-12-0]
2-[(5-Bromo-3-pyridyl)oxy]-2-phenylacetonitrile
[5724-76-5]
3-(2,5-Dioxopyrrolidin-1-yl)propionic acid
[2241982-86-3]
3-(Phenyl-2-D)propanenitrile-2,2-D2

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
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1