PF-5081090


Chemical Name: PF-5081090
CAS Number: 1312473-63-4
Product Number: AG009EAK(AGN-PC-0WAG0T)
Synonyms:
MDL No:
Molecular Formula: C18H21FN2O6S
Molecular Weight: 412.4325

Identification/Properties


Computed Properties
Molecular Weight:
412.432g/mol
XLogP3:
0.5
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
7
Rotatable Bond Count:
7
Exact Mass:
412.11g/mol
Monoisotopic Mass:
412.11g/mol
Topological Polar Surface Area:
121A^2
Heavy Atom Count:
28
Formal Charge:
0
Complexity:
775
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

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NMR Spectrum


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