Entecavir intermediate N5
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Entecavir intermediate N5
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CAS No:
142217-78-5
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Formula:
C52H49N5O5
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Chemical Name:
Entecavir intermediate N5
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Synonyms:
(1S,2S,3S,5S)-3-(benzyloxy)-5-(6-(benzyloxy)-2-(((4-methoxyphenyl)diphenylmethyl)amino)-9H-purin-9-yl)-2-((benzyloxy)methyl)cyclopentanol;SCHEMBL8781302;CTK8B4770;C52H49N5O5;(1S,2S,3S,5S)-5-[2-[[(4-methoxyphenyl)-diphenylmethyl]amino]-6-phenylmethoxypurin-9-yl]-3-phenylmethoxy-2-(phenylmethoxymethyl)cyclopentan-1-ol;ANW-46139;CB0018;AKOS015998591;ZINC150342228;W3097
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CAS No:
Computed Properties
Molecular Weight:824.0
XLogP3:9.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:17
Exact Mass:823.37336968
Monoisotopic Mass:823.37336968
Topological Polar Surface Area:113
Heavy Atom Count:62
Complexity:1270
Defined Atom Stereocenter Count:3
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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