3-Isoquinolinecarboxamide,1-(2-chlorophenyl)-N-methyl-N-(1-methylpropyl)-


Chemical Name: 3-Isoquinolinecarboxamide,1-(2-chlorophenyl)-N-methyl-N-(1-methylpropyl)-
CAS Number: 85532-75-8
Product Number: AG004R3B(AGN-PC-0V12VM)
Synonyms:
MDL No:
Molecular Formula: C21H21ClN2O
Molecular Weight: 352.8572

Identification/Properties


Computed Properties
Molecular Weight:
352.862g/mol
XLogP3:
5.5
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
4
Exact Mass:
352.134g/mol
Monoisotopic Mass:
352.134g/mol
Topological Polar Surface Area:
33.2A^2
Heavy Atom Count:
25
Formal Charge:
0
Complexity:
457
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


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