7-(4-amino-2-chlorophenyl)-1,3-dimethylpurine-2,6-dione
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7-(4-amino-2-chlorophenyl)-1,3-dimethylpurine-2,6-dione
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CAS No:
72898-65-8
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Formula:
C13H12ClN5O2
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Chemical Name:
7-(4-amino-2-chlorophenyl)-1,3-dimethylpurine-2,6-dione
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Synonyms:
72898-65-8;1H-Purine-2,6-dione, 3,7-dihydro-7-(4-amino-2-chlorophenyl)-1,3-dimethyl-;BRN 1163301;Theophylline, 7-(4-amino-2-chlorophenyl)-;NSC343264;3,7-Dihydro-7-(4-amino-2-chlorophenyl)-1,3-dimethyl-1H-purine-2,6-dione;DTXSID30223189;NSC 343264;NSC-343264;DS-009165;7-(4-Amino-2-chloro-phenyl)-1,3-dimethyl-purine-2,6-dione
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CAS No:
7-(4-amino-2-chlorophenyl)-1,3-dimethylpurine-2,6-dione Basic Attributes
305.72 g/mol
305.0679523 g/mol
343264
DTXSID30223189
Computed Properties
Molecular Weight:305.72
XLogP3:1.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:305.0679523
Monoisotopic Mass:305.0679523
Topological Polar Surface Area:84.5
Heavy Atom Count:21
Complexity:462
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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