84856-30-4
Product Name:
Glycine, N-(1-oxo-2-((2-thienylcarbonyl)thio)propyl)-, 2-(butoxycarbon yl)phenyl ester
Formula:
C21H23NO6S2
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COMPUTED DESCRIPTORS
Molecular Weight | 449.5 g/mol |
---|---|
XLogP3 | 4.7 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 8 |
Rotatable Bond Count | 13 |
Exact Mass | 449.09667980 g/mol |
Monoisotopic Mass | 449.09667980 g/mol |
Topological Polar Surface Area | 152 Ų |
Heavy Atom Count | 30 |
Formal Charge | 0 |
Complexity | 614 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 1 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |