7-(2-hydroxy-3-morpholin-4-ylpropyl)-1,3-dimethylpurine-2,6-dione
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7-(2-hydroxy-3-morpholin-4-ylpropyl)-1,3-dimethylpurine-2,6-dione
structure -
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CAS No:
5135-94-4
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Formula:
C14H21N5O4
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Chemical Name:
7-(2-hydroxy-3-morpholin-4-ylpropyl)-1,3-dimethylpurine-2,6-dione
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Synonyms:
5135-94-4;7-(2-Hydroxy-3-morpholinopropyl)theophylline;BRN 0629570;Theophylline, 7-(2-hydroxy-3-morpholinopropyl)-;Oprea1_167679;DTXSID40965624;AKOS000505896;AKOS022009041;CCG-116490;MCULE-5574912118;ST50296831;7-(2-hydroxy-3-morpholin-4-ylpropyl)-1,3-dimethyl-1,3,7-trihydropurine-2,6-dio ne;7-[2-Hydroxy-3-(morpholin-4-yl)propyl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
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CAS No:
7-(2-hydroxy-3-morpholin-4-ylpropyl)-1,3-dimethylpurine-2,6-dione Basic Attributes
323.35 g/mol
323.15935417 g/mol
Computed Properties
Molecular Weight:323.35
XLogP3:-1.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:4
Exact Mass:323.15935417
Monoisotopic Mass:323.15935417
Topological Polar Surface Area:91.1
Heavy Atom Count:23
Complexity:470
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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