6-bromo-7-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrrolo[2,3-d]pyrimidine-5-carbonitrile
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6-bromo-7-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrrolo[2,3-d]pyrimidine-5-carbonitrile
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CAS No:
57071-79-1
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Formula:
C12H11BrN4O4
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Chemical Name:
6-bromo-7-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrrolo[2,3-d]pyrimidine-5-carbonitrile
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Synonyms:
57071-79-1;NSC169625;DTXSID40305187;NSC-169625;6-bromo-7-pentofuranosyl-7H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile
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CAS No:
6-bromo-7-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrrolo[2,3-d]pyrimidine-5-carbonitrile Basic Attributes
355.14 g/mol
353.99637 g/mol
169625
DTXSID40305187
Computed Properties
Molecular Weight:355.14
XLogP3:-0.3
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:2
Exact Mass:353.99637
Monoisotopic Mass:353.99637
Topological Polar Surface Area:124
Heavy Atom Count:21
Complexity:446
Undefined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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