845866-70-8
Product Name:
(1S,4S)-(+)-2-(4-TRIFLUOROMETHYL-BENZYL)-2,5-DIAZA-BICYCLO[2.2.1]HEPTANE 2CF3COOH
Formula:
C13H15F3N2
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COMPUTED DESCRIPTORS
Molecular Weight | 484.31 g/mol |
---|---|
Hydrogen Bond Donor Count | 3 |
Hydrogen Bond Acceptor Count | 15 |
Rotatable Bond Count | 2 |
Exact Mass | 484.10446049 g/mol |
Monoisotopic Mass | 484.10446049 g/mol |
Topological Polar Surface Area | 89.9 Ų |
Heavy Atom Count | 32 |
Formal Charge | 0 |
Complexity | 381 |
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 | 3 |
Compound Is Canonicalized | Yes |