8-(azepan-1-yl)-3-methyl-7-phenacylpurine-2,6-dione
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8-(azepan-1-yl)-3-methyl-7-phenacylpurine-2,6-dione
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CAS No:
714285-46-8
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Formula:
C20H23N5O3
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Chemical Name:
8-(azepan-1-yl)-3-methyl-7-phenacylpurine-2,6-dione
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Synonyms:
714285-46-8;8-(azepan-1-yl)-3-methyl-7-(2-oxo-2-phenylethyl)-1H-purine-2,6(3H,7H)-dione;SMR000013806;MLS000034644;ZINC801707;MFCD04173769;STL051367;AKOS000579999;AKOS005704238;MCULE-7934383639;8-Azepan-1-yl-3-methyl-7-(2-oxo-2-phenyl-ethyl)-3,7-dihydro-purine-2,6-dione;VU0246721-3;AB00419497-03;SR-01000365049;SR-01000365049-1;F1532-0007;8-(azepan-1-yl)-6-hydroxy-3-methyl-7-(2-oxo-2-phenylethyl)-3,7-dihydro-2H-purin-2-one
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CAS No:
Computed Properties
Molecular Weight:381.4
XLogP3:2.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:381.18008961
Monoisotopic Mass:381.18008961
Topological Polar Surface Area:87.5
Heavy Atom Count:28
Complexity:613
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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