339100-90-2
Product Name:
ETHYL 1,4-BIS(4-CHLOROPHENYL)-6-METHYL-4,7-DIHYDRO-1H-PYRAZOLO[3,4-B]PYRIDINE-5-CARBOXYLATE
Formula:
C22H19Cl2N3O2
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COMPUTED DESCRIPTORS
| Molecular Weight | 428.3 g/mol |
|---|---|
| XLogP3 | 5.7 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 5 |
| Exact Mass | 427.0854322 g/mol |
| Monoisotopic Mass | 427.0854322 g/mol |
| Topological Polar Surface Area | 56.2 Ų |
| Heavy Atom Count | 29 |
| Formal Charge | 0 |
| Complexity | 628 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |