1,5-dimethyl-2-phenyl-4-(7H-purin-6-ylamino)pyrazol-3-one
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1,5-dimethyl-2-phenyl-4-(7H-purin-6-ylamino)pyrazol-3-one
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CAS No:
52972-57-3
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Formula:
C16H15N7O
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Chemical Name:
1,5-dimethyl-2-phenyl-4-(7H-purin-6-ylamino)pyrazol-3-one
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Synonyms:
ANTIPYRINE, 4-(9H-PURIN-6-YLAMINO)-;52972-57-3;4-(9H-Purin-6-ylamino)antipyrine;1-Phenyl-2,3-dimethyl-4-(6'-purinylamino)pyrazolone-5;SMR000017628;Oprea1_372263;MLS000101219;CHEMBL1518915;DTXSID80201013;HMS2254H11;ZINC2004768;STK944622;AKOS001770221;MCULE-7835960306;ST50139464;SR-01000007305;SR-01000007305-1;2,3-dimethyl-1-phenyl-4-(purin-6-ylamino)-3-pyrazolin-5-one;1,5-dimethyl-2-phenyl-4-(9H-purin-6-ylamino)-1,2-dihydro-3H-pyrazol-3-one
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CAS No:
1,5-dimethyl-2-phenyl-4-(7H-purin-6-ylamino)pyrazol-3-one Basic Attributes
321.34 g/mol
321.13380813 g/mol
DTXSID80201013
Computed Properties
Molecular Weight:321.34
XLogP3:2.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:3
Exact Mass:321.13380813
Monoisotopic Mass:321.13380813
Topological Polar Surface Area:90
Heavy Atom Count:24
Complexity:531
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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