122665-86-5
Product Name:
ETHYL 2-[3-(CYANOMETHYL)-4-OXO-3,4-DIHYDROPHTHALAZIN-1-YL]ACETATE
Formula:
C14H13N3O3
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COMPUTED DESCRIPTORS
| Molecular Weight | 271.27 g/mol |
|---|---|
| XLogP3 | 1.4 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 5 |
| Exact Mass | 271.09569129 g/mol |
| Monoisotopic Mass | 271.09569129 g/mol |
| Topological Polar Surface Area | 82.8 Ų |
| Heavy Atom Count | 20 |
| Formal Charge | 0 |
| Complexity | 477 |
| 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 |