680579-72-0
Product Name:
N1-DI[3,5-DI(TRIFLUOROMETHYL)PHENYL]METHYL-3-BROMOBUTANAMIDE
Formula:
C21H14BrF12NO
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COMPUTED DESCRIPTORS
| Molecular Weight | 604.2 g/mol |
|---|---|
| XLogP3 | 7.4 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 13 |
| Rotatable Bond Count | 5 |
| Exact Mass | 603.00671 g/mol |
| Monoisotopic Mass | 603.00671 g/mol |
| Topological Polar Surface Area | 29.1 Ų |
| Heavy Atom Count | 36 |
| Formal Charge | 0 |
| Complexity | 653 |
| 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 |