4-Pyrimidinecarboxamide, N-[(2S)-3-(3,4-dihydro-2(1H)-isoquinolinyl)-2-hydroxypropyl]-6-(3-oxetanylamino)-


Chemical Name: 4-Pyrimidinecarboxamide, N-[(2S)-3-(3,4-dihydro-2(1H)-isoquinolinyl)-2-hydroxypropyl]-6-(3-oxetanylamino)-
CAS Number: 1616391-65-1
Product Number: AG001VR4(AGN-PC-0WALBL)
Synonyms:
MDL No:
Molecular Formula: C20H25N5O3
Molecular Weight: 383.4442

Identification/Properties


Computed Properties
Molecular Weight:
383.452g/mol
XLogP3:
0.8
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
7
Rotatable Bond Count:
7
Exact Mass:
383.196g/mol
Monoisotopic Mass:
383.196g/mol
Topological Polar Surface Area:
99.6A^2
Heavy Atom Count:
28
Formal Charge:
0
Complexity:
518
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

Safety Information


NMR Spectrum


Other Analytical Data


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