329767-30-8
Product Name:
dimethyl 7-phenyl-2,4a,5,9-tetrahydro-[1,3]dioxepino[5,6-d]pyridazine-1,4-dicarboxylate
Formula:
C17H18N2O6
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 346.3 g/mol |
|---|---|
| XLogP3 | 1 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 8 |
| Rotatable Bond Count | 5 |
| Exact Mass | 346.11648630 g/mol |
| Monoisotopic Mass | 346.11648630 g/mol |
| Topological Polar Surface Area | 95.4 Ų |
| Heavy Atom Count | 25 |
| Formal Charge | 0 |
| Complexity | 594 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 2 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |