4-Amino-1H-pyrazolo[3,4-b]pyridine - CAS 49834-62-0

Catalog:	BB026837
Product Name:	4-Amino-1H-pyrazolo[3,4-b]pyridine
CAS:	49834-62-0
Synonyms:	1H-pyrazolo[3,4-b]pyridin-4-amine; 1H-pyrazolo[3,4-b]pyridin-4-amine

Technical Data

Patents

Computed Properties

IUPAC Name:	1H-pyrazolo[3,4-b]pyridin-4-amine
Description:	4-Amino-1H-pyrazolo[3,4-b]pyridine (CAS# 49834-62-0) is a useful research chemical compound.
Molecular Weight:	134.14
Molecular Formula:	C6H6N4
Canonical SMILES:	C1=CN=C2C(=C1N)C=NN2
InChI:	InChI=1S/C6H6N4/c7-5-1-2-8-6-4(5)3-9-10-6/h1-3H,(H3,7,8,9,10)
InChI Key:	ROGKJJGNQJKPFJ-UHFFFAOYSA-N
Boiling Point:	428.6 °C at 760 mmHg
Density:	1.48 g/cm³
LogP:	1.12130

Publication Number	Title	Priority Date
AU-2017384481-A1	Pyrazolo[3,4-b]pyridines and imidazo[1,5-b]pyridazines as PDE1 inhibitors	20161222
CA-3046588-A1	Pyrazolo[3,4-b]pyridines and imidazo[1,5-b]pyridazines as pde1 inhibitors	20161222
CN-110099901-A	Pyrazolo [3,4-b] pyridine and imidazo [1,5-b] pyridazine as PDE1 inhibitor	20161222
EP-3558988-A1	Pyrazolo[3,4-b]pyridines and imidazo[1,5-b]pyridazines as pde1 inhibitors	20161222
JP-2020502230-A	Pyrazolo [3,4-b] pyridine and imidazo [1,5-b] pyridazine as PDE1 inhibitors	20161222

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Complexity:	127
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	134.059246208
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	134.059246208
Rotatable Bond Count:	0
Topological Polar Surface Area:	67.6
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.1