1295509-64-6
Product Name:
(8α,9S)- 9-isothiocyanato-6'-Methoxy-Cinchonan
Formula:
C21H23N3OS
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COMPUTED DESCRIPTORS
Molecular Weight | 365.5 g/mol |
---|---|
XLogP3 | 5.1 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 5 |
Rotatable Bond Count | 5 |
Exact Mass | 365.15618354 g/mol |
Monoisotopic Mass | 365.15618354 g/mol |
Topological Polar Surface Area | 69.8 Ų |
Heavy Atom Count | 26 |
Formal Charge | 0 |
Complexity | 564 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 4 |
Undefined Atom Stereocenter Count | 0 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |