2-[[4-(5-ethylpyrimidin-4-yl)piperazin-1-yl]methyl]-6-(trifluoromethyl)-1H-benzimidazole


Chemical Name: 2-[[4-(5-ethylpyrimidin-4-yl)piperazin-1-yl]methyl]-6-(trifluoromethyl)-1H-benzimidazole
CAS Number: 1255517-76-0
Product Number: AG009CE5(AGN-PC-0940P1)
Synonyms:
MDL No: MFCD18086922
Molecular Formula: C19H21F3N6
Molecular Weight: 390.4054

Identification/Properties


Computed Properties
Molecular Weight:
390.414g/mol
XLogP3:
3.2
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
8
Rotatable Bond Count:
4
Exact Mass:
390.178g/mol
Monoisotopic Mass:
390.178g/mol
Topological Polar Surface Area:
60.9A^2
Heavy Atom Count:
28
Formal Charge:
0
Complexity:
510
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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