N-(4-chlorophenyl)-4-(pyridin-4-ylmethyl)phthalazin-1-amine;dihydrochloride


Chemical Name: N-(4-chlorophenyl)-4-(pyridin-4-ylmethyl)phthalazin-1-amine;dihydrochloride
CAS Number: 212141-51-0
Product Number: AG00BF56(AGN-PC-03OKL9)
Synonyms:
MDL No:
Molecular Formula: C20H17Cl3N4
Molecular Weight: 419.7348

Identification/Properties


Computed Properties
Molecular Weight:
419.734g/mol
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
4
Exact Mass:
418.052g/mol
Monoisotopic Mass:
418.052g/mol
Topological Polar Surface Area:
50.7A^2
Heavy Atom Count:
27
Formal Charge:
0
Complexity:
407
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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