122454-52-8
Product Name:
(2S,3aS,7aS)-1-[(2S)-2-[[(1S)-1-(Ethoxycarbonyl)butyl]aMino]-1-oxopropyl]octahydro-1H-indole-2-carboxylic Acid Benzyl Ester
Formula:
C26H38N2O5
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COMPUTED DESCRIPTORS
Molecular Weight | 458.6 g/mol |
---|---|
XLogP3 | 5 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 6 |
Rotatable Bond Count | 12 |
Exact Mass | 458.27807232 g/mol |
Monoisotopic Mass | 458.27807232 g/mol |
Topological Polar Surface Area | 84.9 Ų |
Heavy Atom Count | 33 |
Formal Charge | 0 |
Complexity | 663 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 5 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |