2489212-72-6
Product Name:
8,8'-((3R,3'R)-(methylenebis(azanediyl))bis(piperidine-3,1-diyl))bis(7-(but-2-yn-1-yl)-3-methyl-1-((4-methylquinazolin-2-yl)methyl)-3,7-dihydro-1H-purine-2,6-dione)
Formula:
C51H56N16O4
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 957.1 g/mol |
|---|---|
| XLogP3 | 4.7 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 14 |
| Rotatable Bond Count | 12 |
| Exact Mass | 956.46704433 g/mol |
| Monoisotopic Mass | 956.46704433 g/mol |
| Topological Polar Surface Area | 199 Ų |
| Heavy Atom Count | 71 |
| Formal Charge | 0 |
| Complexity | 1960 |
| 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 |