2, 4, 5, 6- Tetrahydro-1H- pyrazolo[3, 4- b] pyridine - CAS 933734-43-1

Name: 2, 4, 5, 6- Tetrahydro-1H- pyrazolo[3, 4- b] pyridine
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB064401
Product Name:	2, 4, 5, 6- Tetrahydro-1H- pyrazolo[3, 4- b] pyridine
CAS:	933734-43-1
Synonyms:	1H,4H,5H,6H,7H-Pyrazolo[3,4-b]pyridine

Technical Data

IUPAC Name:	4,5,6,7-tetrahydro-1H-pyrazolo[3,4-b]pyridine
Description:	2, 4, 5, 6- Tetrahydro-1H- pyrazolo[3, 4- b] pyridine is used as a reactant in the preparation of 6,7-dihydro-5H-pyrrolo[3,4-b]pyridinone derivatives as tyrosine-protein kinase 2 inhibitors and uses thereof.
Molecular Weight:	123.16
Molecular Formula:	C6H9N3
Canonical SMILES:	C1CC2=C(NC1)NN=C2
InChI:	InChI=1S/C6H9N3/c1-2-5-4-8-9-6(5)7-3-1/h4H,1-3H2,(H2,7,8,9)
InChI Key:	NTAKFWAOAWPPMJ-UHFFFAOYSA-N
Melting Point:	80 - 82°C
Solubility:	Chloroform (Sparingly), Methanol (Slightly)
Appearance:	White to Pale Yellow Solid
Storage:	-20°C Freezer, Under inert atmosphere
References:	Masse, C., et al. PCT Int. Appl. (2017), WO 2017040757 A1 20170309..

Complexity:	105
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	123.0796473
Formal Charge:	0
Heavy Atom Count:	9
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	123.0796473
Rotatable Bond Count:	0
Topological Polar Surface Area:	40.7Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.9