956948-86-0
Product Name:
6,7-dimethoxy-1-(4-methoxyphenyl)-N-[(2S)-1-oxo-1-(propan-2-ylamino)propan-2-yl]-3,4-dihydro-1H-isoquinoline-2-carboxamide
Formula:
C25H33N3O5
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COMPUTED DESCRIPTORS
| Molecular Weight | 455.5 g/mol |
|---|---|
| XLogP3 | 3.2 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 7 |
| Exact Mass | 455.24202116 g/mol |
| Monoisotopic Mass | 455.24202116 g/mol |
| Topological Polar Surface Area | 89.1 Ų |
| Heavy Atom Count | 33 |
| Formal Charge | 0 |
| Complexity | 652 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 1 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |