Pyrimidine, 2-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-


Chemical Name: Pyrimidine, 2-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-
CAS Number: 3605-01-4
Product Number: AG0039YE(AGN-PC-0JK71E)
Synonyms:
MDL No:
Molecular Formula: C16H18N4O2
Molecular Weight: 298.3397

Identification/Properties


Computed Properties
Molecular Weight:
298.346g/mol
XLogP3:
1.8
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
3
Exact Mass:
298.143g/mol
Monoisotopic Mass:
298.143g/mol
Topological Polar Surface Area:
50.7A^2
Heavy Atom Count:
22
Formal Charge:
0
Complexity:
356
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

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NMR Spectrum


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