7-(4-bromobenzyl)-8-[(2-hydroxypropyl)amino]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
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7-(4-bromobenzyl)-8-[(2-hydroxypropyl)amino]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
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CAS No:
353762-19-3
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Formula:
C17H20BrN5O3
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Chemical Name:
7-(4-bromobenzyl)-8-[(2-hydroxypropyl)amino]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
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Synonyms:
7-(4-bromobenzyl)-8-[(2-hydroxypropyl)amino]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione;Oprea1_250488;Oprea1_443872;STK038475;AKOS000663183;AKOS022078295;MCULE-6998202472;NCGC00287752-01;ST50262338;AB01283094-01
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CAS No:
7-(4-bromobenzyl)-8-[(2-hydroxypropyl)amino]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione Basic Attributes
422.2764
421.075
Computed Properties
Molecular Weight:422.3
XLogP3:1.9
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:421.07495
Monoisotopic Mass:421.07495
Topological Polar Surface Area:90.7
Heavy Atom Count:26
Complexity:543
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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