942206-37-3
Product Name:
METHYL 6-(TRIFLUOROMETHYL)-1-TOSYL-1H-PYRROLO-[2,3-B]PYRIDINE-3-CARBOXYLATE
Formula:
C17H13F3N2O4S
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COMPUTED DESCRIPTORS
| Molecular Weight | 398.4 g/mol |
|---|---|
| XLogP3 | 3.6 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 8 |
| Rotatable Bond Count | 4 |
| Exact Mass | 398.05481256 g/mol |
| Monoisotopic Mass | 398.05481256 g/mol |
| Topological Polar Surface Area | 86.6 Ų |
| Heavy Atom Count | 27 |
| Formal Charge | 0 |
| Complexity | 656 |
| 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 |