944949-06-8
Product Name:
(6aR,8S,10aS)-10a-(4-chlorophenylsulfonyl)-1,4-difluoro-6a,7,8,9,10,10a-hexahydro-6H-benzo[c]chroMen-8-ol
Formula:
C19H17ClF2O4S
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COMPUTED DESCRIPTORS
Molecular Weight | 414.9 g/mol |
---|---|
XLogP3 | 3.6 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 6 |
Rotatable Bond Count | 2 |
Exact Mass | 414.0504142 g/mol |
Monoisotopic Mass | 414.0504142 g/mol |
Topological Polar Surface Area | 72 Ų |
Heavy Atom Count | 27 |
Formal Charge | 0 |
Complexity | 649 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 3 |
Undefined Atom Stereocenter Count | 0 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |