163706-52-3
Product Name:
Adenosine,N-acetyl-2-[(3,3,3-trifluoropropyl)thio]-,2',3',5'-triacetate (9CI)
Formula:
C21H24F3N5O8S
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COMPUTED DESCRIPTORS
| Molecular Weight | 563.5 g/mol |
|---|---|
| XLogP3 | 1.4 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 15 |
| Rotatable Bond Count | 12 |
| Exact Mass | 563.12976840 g/mol |
| Monoisotopic Mass | 563.12976840 g/mol |
| Topological Polar Surface Area | 186 Ų |
| Heavy Atom Count | 38 |
| Formal Charge | 0 |
| Complexity | 899 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 4 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |