1026753-54-7
Product Name:
IMatinib Para-diaMinoMethylbenzene
Formula:
C29H31N7O
Synonyms:
3-Acetylpyridine;Methyl 3-pyridyl ketone
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COMPUTED DESCRIPTORS
| Molecular Weight | 493.6 g/mol |
|---|---|
| XLogP3 | 3.5 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 7 |
| Exact Mass | 493.25900864 g/mol |
| Monoisotopic Mass | 493.25900864 g/mol |
| Topological Polar Surface Area | 86.3 Ų |
| Heavy Atom Count | 37 |
| Formal Charge | 0 |
| Complexity | 706 |
| 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 |