4-[(9-benzyl-2-chloropurin-6-yl)amino]benzonitrile
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4-[(9-benzyl-2-chloropurin-6-yl)amino]benzonitrile
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CAS No:
125802-53-1
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Formula:
C19H13ClN6
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Chemical Name:
4-[(9-benzyl-2-chloropurin-6-yl)amino]benzonitrile
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Synonyms:
Benzonitrile,4-[[2-chloro-9-(phenylmethyl)-9H-purin-6-yl]amino];
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CAS No:
Computed Properties
Molecular Weight:360.8
XLogP3:4.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:360.0890221
Monoisotopic Mass:360.0890221
Topological Polar Surface Area:79.4
Heavy Atom Count:26
Complexity:507
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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