477867-38-2
Product Name:
ETHYL 3-(4-[5-CHLORO-1-(3-CHLOROPHENYL)-6-OXO-1,6-DIHYDRO-4-PYRIDAZINYL]PIPERAZINO)-2-CYANOACRYLATE
Formula:
C20H19Cl2N5O3
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COMPUTED DESCRIPTORS
| Molecular Weight | 448.3 g/mol |
|---|---|
| XLogP3 | 3.1 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 6 |
| Exact Mass | 447.0864949 g/mol |
| Monoisotopic Mass | 447.0864949 g/mol |
| Topological Polar Surface Area | 89.2 Ų |
| Heavy Atom Count | 30 |
| Formal Charge | 0 |
| Complexity | 824 |
| 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 |