92829-12-4
Product Name:
[S-(R*,R*)]-2-[2-[[(1,1-DiMethylethoxy)carbonyl]aMino]-1-oxopropyl]-1,2,3,4-tetrahydro-3-isoquinolinecarboxylic Acid PhenylMethyl
Formula:
C25H30N2O5
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COMPUTED DESCRIPTORS
| Molecular Weight | 438.5 g/mol |
|---|---|
| XLogP3 | 3.8 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 8 |
| Exact Mass | 438.21547206 g/mol |
| Monoisotopic Mass | 438.21547206 g/mol |
| Topological Polar Surface Area | 84.9 Ų |
| Heavy Atom Count | 32 |
| Formal Charge | 0 |
| Complexity | 668 |
| 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 |