6-[(2-chloro-6-fluorophenyl)methylsulfanyl]-3,7-dihydropurin-2-one
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6-[(2-chloro-6-fluorophenyl)methylsulfanyl]-3,7-dihydropurin-2-one
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CAS No:
646511-01-5
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Formula:
C12H8ClFN4OS
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Chemical Name:
6-[(2-chloro-6-fluorophenyl)methylsulfanyl]-3,7-dihydropurin-2-one
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Synonyms:
AC1L9XTP;646511-01-5;DTXSID10333018;6-(2-Chloro-6-fluorobenzylthio)2-hydroxypurine;6-[(2-chloro-6-fluoro-phenyl)methylsulfanyl]-9H-purin-2-ol
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CAS No:
6-[(2-chloro-6-fluorophenyl)methylsulfanyl]-3,7-dihydropurin-2-one Basic Attributes
310.74 g/mol
310.0091379 g/mol
DTXSID10333018
Computed Properties
Molecular Weight:310.74
XLogP3:2.7
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:310.0091379
Monoisotopic Mass:310.0091379
Topological Polar Surface Area:95.4
Heavy Atom Count:20
Complexity:424
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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