6-Methyl-1H-pyrrolo[2,3-b]pyridine - CAS 824-51-1

Catalog:	BB036832
Product Name:	6-Methyl-1H-pyrrolo[2,3-b]pyridine
CAS:	824-51-1
Synonyms:	6-methyl-1H-pyrrolo[2,3-b]pyridine; 6-methyl-1H-pyrrolo[2,3-b]pyridine

Technical Data

Patents

Computed Properties

IUPAC Name:	6-methyl-1H-pyrrolo[2,3-b]pyridine
Description:	Intermediate in the preparation of Thyroxin derivatives.
Molecular Weight:	132.16
Molecular Formula:	C8H8N2
Canonical SMILES:	CC1=NC2=C(C=C1)C=CN2
InChI:	InChI=1S/C8H8N2/c1-6-2-3-7-4-5-9-8(7)10-6/h2-5H,1H3,(H,9,10)
InChI Key:	YQDMUZFABFBKJN-UHFFFAOYSA-N
Boiling Point:	259.634 °C at 760 mmHg
Density:	1.187 g/cm³
LogP:	1.87130

Publication Number	Title	Priority Date
WO-2021072487-A1	Sulfonamide compounds and the use thereof in the treatment of cancer	20191015
WO-2021064141-A1	Inhibitors of dual specificity tyrosine phosphorylation regulated kinase 1b	20191002
US-2021078996-A1	Hpk1 antagonists and uses thereof	20190913
US-2021078997-A1	SUBSTITUTED ISOINDOLIN-1-ONES AND 2,3-DIHYDRO-1H-PYRROL[3,4-c]PYRIDIN-1-ONES AS HPK1 ANTAGONISTS	20190913
US-2021078998-A1	SUBSTITUTED ISOINDOLIN-1-ONES AND 2,3-DIHYDRO-1H-PYRROLO[3,4-c]PYRIDIN-1-ONES AS HPK1 ANTAGONISTS	20190913

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Complexity:	124
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	132.068748264
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	132.068748264
Rotatable Bond Count:	0
Topological Polar Surface Area:	28.7
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.7