860648-73-3
Product Name:
TERT-BUTYL 4-[4-(([(4,5-DIBROMO-1H-PYRROL-2-YL)CARBONYL]AMINO)METHYL)PHENYL]TETRAHYDRO-1(2H)-PYRAZINECARBOXYLATE
Formula:
C21H26Br2N4O3
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COMPUTED DESCRIPTORS
| Molecular Weight | 542.3 g/mol |
|---|---|
| XLogP3 | 4.3 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 6 |
| Exact Mass | 542.03512 g/mol |
| Monoisotopic Mass | 540.03717 g/mol |
| Topological Polar Surface Area | 77.7 Ų |
| Heavy Atom Count | 30 |
| Formal Charge | 0 |
| Complexity | 600 |
| 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 |