130830-60-3
Product Name:
(2R, 4R)-4-(TOLUENE-4-SULFONYLOXY)-1-[BENZYLOXYCARBONYL]-PYRROLIDINE-2-ETHYLCARBOXYLATE
Formula:
C22H25NO7S
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COMPUTED DESCRIPTORS
Molecular Weight | 447.5 g/mol |
---|---|
XLogP3 | 3.5 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 7 |
Rotatable Bond Count | 9 |
Exact Mass | 447.13517331 g/mol |
Monoisotopic Mass | 447.13517331 g/mol |
Topological Polar Surface Area | 108 Ų |
Heavy Atom Count | 31 |
Formal Charge | 0 |
Complexity | 706 |
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 |