169340-04-9
Product Name:
1,2-Propanedione, 1-[4-[4-[(4-chlorophenyl)amino]-6,7-dihydro-6-(1-methylethyl)-7-oxo-5H-pyrrolo[3,4-d]pyrimidin-2-yl]-1-piperazinyl]-, 2-oxime
Formula:
C22H26ClN7O3
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 471.9 g/mol |
|---|---|
| XLogP3 | 3.3 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 8 |
| Rotatable Bond Count | 5 |
| Exact Mass | 471.1785654 g/mol |
| Monoisotopic Mass | 471.1785654 g/mol |
| Topological Polar Surface Area | 114 Ų |
| Heavy Atom Count | 33 |
| Formal Charge | 0 |
| Complexity | 750 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |