Apararenone


Chemical Name: Apararenone
CAS Number: 945966-46-1
Product Number: AG01EOE9(AGN-PC-3H46C7)
Synonyms:
MDL No:
Molecular Formula: C17H17FN2O4S
Molecular Weight: 364.3913

Identification/Properties


Computed Properties
Molecular Weight:
364.391g/mol
XLogP3:
2.3
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
3
Exact Mass:
364.089g/mol
Monoisotopic Mass:
364.089g/mol
Topological Polar Surface Area:
84.1A^2
Heavy Atom Count:
25
Formal Charge:
0
Complexity:
611
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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