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4-(Methylamino)-2-(methylthio)pyrimidine-5-methanol

4-(Methylamino)-2-(methylthio)pyrimidine-5-methanol - CAS 17759-30-7

Catalog:	BB013309
Product Name:	4-(Methylamino)-2-(methylthio)pyrimidine-5-methanol
CAS:	17759-30-7
Synonyms:	[4-(methylamino)-2-(methylthio)-5-pyrimidinyl]methanol; [4-(methylamino)-2-methylsulfanylpyrimidin-5-yl]methanol

Technical Data

Patents

Computed Properties

IUPAC Name:	[4-(methylamino)-2-methylsulfanylpyrimidin-5-yl]methanol
Description:	An intermediate in the preparation of antitumor agents and tyrosine kinase inhibitors.
Molecular Weight:	185.25
Molecular Formula:	C7H11N3OS
Canonical SMILES:	CNC1=NC(=NC=C1CO)SC
InChI:	InChI=1S/C7H11N3OS/c1-8-6-5(4-11)3-9-7(10-6)12-2/h3,11H,4H2,1-2H3,(H,8,9,10)
InChI Key:	NXNGLEYSIAXGCL-UHFFFAOYSA-N
Boiling Point:	398.921 °C at 760 mmHg
Density:	1.289 g/cm³
LogP:	0.15440

Publication Number	Title	Priority Date
KR-20210092358-A	7-amino-3,4-dihydropyrimido pyrimidin-2-one derivatives as protein kinase inhibitors and pharmaceutical compositions for treating disease containing the same	20200115
WO-2021145520-A1	7-amino-3,4-dihydropyrimidopyrimidin-2-one derivative having inhibitory activity for protein kinases and therapeutic pharmaceutical composition comprising same	20200115
WO-2020232190-A1	Protein kinase inhibitors and uses thereof for the treatment of diseases and conditions	20190516
TW-201910331-A	Fibroblast growth factor receptor inhibitor, pharmaceutical preparation containing the same, and use thereof	20170808
WO-2019029541-A1	FIBROBLAST GROWTH FACTOR RECEPTOR INHIBITOR AND USE THEREOF	20170808

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Complexity:	136
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	185.06228316
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	5
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	185.06228316
Rotatable Bond Count:	3
Topological Polar Surface Area:	83.3
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1