5-Aminopyrimidine-2-carboxylic Acid - CAS 56621-98-8

Catalog:	BB029434
Product Name:	5-Aminopyrimidine-2-carboxylic Acid
CAS:	56621-98-8
Synonyms:	5-amino-2-pyrimidinecarboxylic acid; 5-aminopyrimidine-2-carboxylic acid

Technical Data

Patents

Computed Properties

IUPAC Name:	5-aminopyrimidine-2-carboxylic acid
Description:	5-Aminopyrimidine-2-carboxylic Acid (CAS# 56621-98-8) is used as a reagent in the synthesis of CDK7 inhibitors.
Molecular Weight:	139.11
Molecular Formula:	C5H5N3O2
Canonical SMILES:	C1=C(C=NC(=N1)C(=O)O)N
InChI:	InChI=1S/C5H5N3O2/c6-3-1-7-4(5(9)10)8-2-3/h1-2H,6H2,(H,9,10)
InChI Key:	GFQGXKOUBNWXJA-UHFFFAOYSA-N
Boiling Point:	484.8 °C at 760 mmHg
Density:	1.533 g/cm³
LogP:	0.33820

Publication Number	Title	Priority Date
WO-2015154039-A2	Inhibitors of cyclin-dependent kinase 7 (cdk7)	20140404
AU-2014225604-A1	Perfluorinated cyclopropyl fused 1,3-oxazin-2-amine compounds as beta-secretase inhibitors and methods of use	20130308
AU-2014225604-B2	Perfluorinated cyclopropyl fused 1,3-oxazin-2-amine compounds as beta-secretase inhibitors and methods of use	20130308
CA-2903215-A1	Perfluorinated cyclopropyl fused 1,3-oxazin-2-amine compounds as beta-secretase inhibitors and methods of use	20130308
CN-105164121-A	Perfluorinated cyclopropyl fused 1,3-oxazin-2-amine compounds as beta-secretase inhibitors and methods of use	20130308

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Related Functional Groups

Carbonyl Compounds

[89908-23-6]
2-Propenoic acid, 2-(3',3'-dimethyl-6-nitrospiro[2H-1-benzopyran-2,2'-[2H]indol]-1'(3'H)-yl)ethyl ester
[956439-56-8]
1-(Carboxymethyl)-3-nitro-1H-pyrazole-5-carboxylic acid
[70912-52-6]
1,3-Dioxane-4,6-dione,2,2-dimethyl-5-(2-pyrrolidinylidene)-
[1431966-64-1]
1-{2-[(3-Methoxypropyl)amino]-4-methyl-1,3-thiazol-5-yl}ethanone hydrochloride
[253429-30-0]
1-Bromo-2-(2,2-diethoxyethoxy)-4-fluorobenzene
[957292-12-5]
2-(3-Cyclopropyl-1H-pyrazol-1-yl)acetic acid

Complexity:	131
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	139.038176411
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	5
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	139.038176411
Rotatable Bond Count:	1
Topological Polar Surface Area:	89.1
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	-0.6