Atorvastatin Ellyl Ester


Chemical Name: Atorvastatin Ellyl Ester
CAS Number: 915092-85-2
Product Number: AG00GW1J(AGN-PC-0VSMT9)
Synonyms:
MDL No:
Molecular Formula: C36H39FN2O5
Molecular Weight: 598.7036632

Identification/Properties


Computed Properties
Molecular Weight:
598.715g/mol
XLogP3:
5.9
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
15
Exact Mass:
598.284g/mol
Monoisotopic Mass:
598.284g/mol
Topological Polar Surface Area:
101A^2
Heavy Atom Count:
44
Formal Charge:
0
Complexity:
897
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
2
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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