591736-30-0
Product Name:
{4-[3-(3,4-dihydroisoquinolin-2(1H)-yl)-4-nitrophenyl]piperazin-1-yl}[3-(propan-2-yloxy)phenyl]methanone
Formula:
C29H32N4O4
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COMPUTED DESCRIPTORS
| Molecular Weight | 500.6 g/mol |
|---|---|
| XLogP3 | 5.2 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 5 |
| Exact Mass | 500.24235551 g/mol |
| Monoisotopic Mass | 500.24235551 g/mol |
| Topological Polar Surface Area | 81.8 Ų |
| Heavy Atom Count | 37 |
| Formal Charge | 0 |
| Complexity | 780 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |