2,4-dioxo-5-(piperidin-1-ylmethyl)-1H-pyrimidine-6-carboxylic acid
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2,4-dioxo-5-(piperidin-1-ylmethyl)-1H-pyrimidine-6-carboxylic acid
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CAS No:
4116-21-6
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Formula:
C11H15N3O4
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Chemical Name:
2,4-dioxo-5-(piperidin-1-ylmethyl)-1H-pyrimidine-6-carboxylic acid
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Synonyms:
4116-21-6;NSC52389;2,6-dioxo-5-(piperidin-1-ylmethyl)-1,2,3,6-tetrahydropyrimidine-4-carboxylic acid;2,6-Dioxo-5-piperidin-1-ylmethyl-1,2,3,6-tetrahydro-pyrimidine-4-carboxylic acid;NSC-52389;2,6-dioxo-5-(piperidylmethyl)-1,3-dihydropyrimidine-4-carboxylic acid;NCIStruc1_000463;NCIStruc2_000387;Oprea1_351128;CBDivE_009692;CHEMBL1405565;ZINC55669;NCI52389;BBL028760;CCG-37713;NCGC00013648;SBB043314;STK592389;STL163407;AKOS000111539;AKOS005514299;MCULE-6461869384;NCGC00013648-02;NCGC00096760-01;NCI60_004276;ST021987;VS-08952;BB 0238458;SR-01000518179;SR-01000518179-1;BRD-K24038471-001-01-5;2,6-dihydroxy-5-(1-piperidinylmethyl)-4-pyrimidinecarboxylic acid;2,6-dihydroxy-5-(piperidin-1-ylmethyl)pyrimidine-4-carboxylic acid;2,6-dioxo-5-[(piperidin-1-yl)methyl]-1,2,3,6-tetrahydropyrimidine-4-carboxylic acid;2,6-Dioxo-5-piperidin-1-ylmethyl-1,2,3,6-tetr ahydro-pyrimidine-4-carboxylic acid
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CAS No:
2,4-dioxo-5-(piperidin-1-ylmethyl)-1H-pyrimidine-6-carboxylic acid Basic Attributes
253.25 g/mol
253.10625597 g/mol
Computed Properties
Molecular Weight:253.25
XLogP3:-2.8
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:253.10625597
Monoisotopic Mass:253.10625597
Topological Polar Surface Area:98.7
Heavy Atom Count:18
Complexity:424
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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