478030-87-4
Product Name:
DIETHYL 6-(4-[3-CHLORO-5-(TRIFLUOROMETHYL)-2-PYRIDINYL]PIPERAZINO)-2-OXO-1,2-DIHYDRO-3,5-PYRIDINEDICARBOXYLATE
Formula:
C21H22ClF3N4O5
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COMPUTED DESCRIPTORS
| Molecular Weight | 502.9 g/mol |
|---|---|
| XLogP3 | 3.3 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 11 |
| Rotatable Bond Count | 8 |
| Exact Mass | 502.1230820 g/mol |
| Monoisotopic Mass | 502.1230820 g/mol |
| Topological Polar Surface Area | 101 Ų |
| Heavy Atom Count | 34 |
| Formal Charge | 0 |
| Complexity | 871 |
| 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 |