903184-74-7
Product Name:
(E)-4-chlorobenzaldehyde O-((8,9-dimethyl-7-(pyridin-3-yl)-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl)methyl) oxime
Formula:
C22H18ClN7O
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COMPUTED DESCRIPTORS
| Molecular Weight | 431.9 g/mol |
|---|---|
| XLogP3 | 4.1 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 5 |
| Exact Mass | 431.1261359 g/mol |
| Monoisotopic Mass | 431.1261359 g/mol |
| Topological Polar Surface Area | 82.5 Ų |
| Heavy Atom Count | 31 |
| Formal Charge | 0 |
| Complexity | 631 |
| 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 |