7-(4-aminophenyl)-1,3-dimethylpurine-2,6-dione
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7-(4-aminophenyl)-1,3-dimethylpurine-2,6-dione
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CAS No:
963-48-4
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Formula:
C13H13N5O2
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Chemical Name:
7-(4-aminophenyl)-1,3-dimethylpurine-2,6-dione
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Synonyms:
963-48-4;3,7-Dihydro-7-(4-aminophenyl)-1,3-dimethyl-1H-purine-2,6-dione;7-(4-aminophenyl)-1,3-dimethyl-3,7-dihydro-1h-purine-2,6-dione;Theophylline, 7-(p-aminophenyl)-;NSC343263;7-(p-Aminofenil)teofillina [Italian];BRN 0562232;7-(p-Aminofenil)teofillina;DTXSID90914586;1H-Purine-2,6-dione, 3,7-dihydro-7-(4-aminophenyl)-1,3-dimethyl-;ZINC13282299;7-(P-AMINOPHENYL)THEOPHYLLINE;NSC 343263;NSC-343263;DS-004676
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CAS No:
7-(4-aminophenyl)-1,3-dimethylpurine-2,6-dione Basic Attributes
271.27 g/mol
271.10692467 g/mol
343263
Computed Properties
Molecular Weight:271.27
XLogP3:0.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:271.10692467
Monoisotopic Mass:271.10692467
Topological Polar Surface Area:84.5
Heavy Atom Count:20
Complexity:421
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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