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2-amino-6-hydroxy-5-isopropylpyrimidin-4(3H)-one

2-amino-6-hydroxy-5-isopropylpyrimidin-4(3H)-one - CAS 500161-23-9

Catalog:	BB026891
Product Name:	2-amino-6-hydroxy-5-isopropylpyrimidin-4(3H)-one
CAS:	500161-23-9
Synonyms:	2-amino-4-hydroxy-5-propan-2-yl-1H-pyrimidin-6-one; 2-amino-4-hydroxy-5-propan-2-yl-1H-pyrimidin-6-one

Technical Data

Patents

Computed Properties

IUPAC Name:	2-amino-4-hydroxy-5-propan-2-yl-1H-pyrimidin-6-one
Description:	2-amino-6-hydroxy-5-isopropylpyrimidin-4(3H)-one (CAS# 500161-23-9 ) is a useful research chemical.
Molecular Weight:	169.18
Molecular Formula:	C7H11N3O2
Canonical SMILES:	CC(C)C1=C(N=C(NC1=O)N)O
InChI:	InChI=1S/C7H11N3O2/c1-3(2)4-5(11)9-7(8)10-6(4)12/h3H,1-2H3,(H4,8,9,10,11,12)
InChI Key:	GWBXUTJCYUUSDY-UHFFFAOYSA-N
Boiling Point:	430.8 °C at 760 mmHg
Density:	1.352 g/cm³
LogP:	0.35960

Publication Number	Title	Priority Date
US-2017267681-A1	Antiviral azasugar-containing nucleosides	20121116
CZ-2011103-A3	Pyrimidine compounds inhibiting formation of nitrogen monoxide and prostaglandin E2, preparation process and use thereof	20110228
CZ-305457-B6	Pyrimidine compounds inhibiting formation of nitrogen monoxide and prostaglandin E2, process for their preparation and use	20110228
EP-2680847-A1	Pyrimidine compounds inhibiting the formation of nitric oxide and prostaglandin e2, method of production thereof and use thereof	20110228
EP-3195867-A1	Pyrimidine compounds inhibiting the formation of nitric oxide and prostaglandin e2, method of production thereof and use thereof	20110228

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Complexity:	278
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	169.085126602
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	3
Isotope Atom Count:	0
Monoisotopic Mass:	169.085126602
Rotatable Bond Count:	1
Topological Polar Surface Area:	87.7
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	-0.3