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917022-13-0

917022-13-0 structural image
Product Name: Carbamic acid, N-[[trans-4-[[(4-amino-6-chloro-2-pyrimidinyl)amino]methyl]cyclohexyl]methyl]-N-[3-[cyclohexyl[(1,1-dimethylethoxy)carbonyl]amino]propyl]-, 1,1-dimethylethyl ester
Formula: C31H53ClN6O4
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COMPUTED DESCRIPTORS

Molecular Weight 609.2 g/mol
XLogP3 6.8
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 8
Rotatable Bond Count 14
Exact Mass 608.3816819 g/mol
Monoisotopic Mass 608.3816819 g/mol
Topological Polar Surface Area 123 Ų
Heavy Atom Count 42
Formal Charge 0
Complexity 836
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes