54324-79-7
Product Name:
[1,1'-Biphenyl]-4-carboxylic acid [3aR-[3aa,4a(E),5b,6aa]]-4-[4-(3-chlorophenoxy)-3-oxo-1-butenyl]hexahydro-2-oxo-2H-cyclopenta[b]furan-5-yl ester
Formula:
C30H25ClO6
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COMPUTED DESCRIPTORS
Molecular Weight | 517.0 g/mol |
---|---|
XLogP3 | 6.1 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 6 |
Rotatable Bond Count | 9 |
Exact Mass | 516.1339662 g/mol |
Monoisotopic Mass | 516.1339662 g/mol |
Topological Polar Surface Area | 78.9 Ų |
Heavy Atom Count | 37 |
Formal Charge | 0 |
Complexity | 843 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 4 |
Undefined Atom Stereocenter Count | 0 |
Defined Bond Stereocenter Count | 1 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |