956454-12-9
Product Name:
TERT-BUTYL 4-[1-(ANILINOCARBONYL)-5-(2,4-DICHLOROPHENYL)-1H-PYRAZOL-3-YL]TETRAHYDRO-1(2H)-PYRIDINECARBOXYLATE
Formula:
C26H28Cl2N4O3
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COMPUTED DESCRIPTORS
| Molecular Weight | 515.4 g/mol |
|---|---|
| XLogP3 | 5.9 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 5 |
| Exact Mass | 514.1538462 g/mol |
| Monoisotopic Mass | 514.1538462 g/mol |
| Topological Polar Surface Area | 76.5 Ų |
| Heavy Atom Count | 35 |
| Formal Charge | 0 |
| Complexity | 735 |
| 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 |