56083-42-2
Product Name:
4a,4b,5,8,8a,8b-Hexahydro-1,4-di(2-pyridinyl)-5,8-ethenobenzo[3,4]cyclobuta[1,2-d]pyridazine-6,7-dicarboxylic acid dimethyl ester
Formula:
C26H22N4O4
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 454.5 g/mol |
|---|---|
| XLogP3 | 2.5 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 8 |
| Rotatable Bond Count | 6 |
| Exact Mass | 454.16410520 g/mol |
| Monoisotopic Mass | 454.16410520 g/mol |
| Topological Polar Surface Area | 103 Ų |
| Heavy Atom Count | 34 |
| Formal Charge | 0 |
| Complexity | 936 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 6 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |