N-(3-chloro-4-fluorophenyl)-6-[4-(diethylaminomethyl)piperidin-1-yl]pyrimido[5,4-d]pyrimidin-4-amine;dihydrochloride


Chemical Name: N-(3-chloro-4-fluorophenyl)-6-[4-(diethylaminomethyl)piperidin-1-yl]pyrimido[5,4-d]pyrimidin-4-amine;dihydrochloride
CAS Number: 793726-84-8
Product Number: AG005K9W(AGN-PC-07ZVJT)
Synonyms:
MDL No:
Molecular Formula: C22H29Cl3FN7
Molecular Weight: 516.8700

Identification/Properties


Computed Properties
Molecular Weight:
516.871g/mol
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
8
Rotatable Bond Count:
7
Exact Mass:
515.153g/mol
Monoisotopic Mass:
515.153g/mol
Topological Polar Surface Area:
70.1A^2
Heavy Atom Count:
33
Formal Charge:
0
Complexity:
546
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:
3
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


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