(2R)-2-[[6-(3-amino-5-chloroanilino)-9-propan-2-ylpurin-2-yl]amino]-3-methylbutan-1-ol


Chemical Name: (2R)-2-[[6-(3-amino-5-chloroanilino)-9-propan-2-ylpurin-2-yl]amino]-3-methylbutan-1-ol
CAS Number: 220792-57-4
Product Number: AG00BC60(AGN-PC-0LUN09)
Synonyms:
MDL No:
Molecular Formula: C19H26ClN7O
Molecular Weight: 403.9090

Identification/Properties


Properties
Form:
Solid
Computed Properties
Molecular Weight:
403.915g/mol
XLogP3:
3.6
Hydrogen Bond Donor Count:
4
Hydrogen Bond Acceptor Count:
7
Rotatable Bond Count:
7
Exact Mass:
403.189g/mol
Monoisotopic Mass:
403.189g/mol
Topological Polar Surface Area:
114A^2
Heavy Atom Count:
28
Formal Charge:
0
Complexity:
497
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
1
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

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NMR Spectrum


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