137863-89-9
Product Name:
N-[(2'-Cyano[1,1'-biphenyl]-4-yl)methyl]-L-valine methyl ester
Formula:
C20H22N2O2
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COMPUTED DESCRIPTORS
| Molecular Weight | 322.4 g/mol |
|---|---|
| XLogP3 | 3.9 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 7 |
| Exact Mass | 322.168127949 g/mol |
| Monoisotopic Mass | 322.168127949 g/mol |
| Topological Polar Surface Area | 62.1 Ų |
| Heavy Atom Count | 24 |
| Formal Charge | 0 |
| Complexity | 446 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 1 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |