704877-28-1
Product Name:
ETHYL 7-AMINO-2-(TRIFLUOROMETHYL)[1,2,4]TRIAZOLO[1,5-A]PYRIMIDINE-6-CARBOXYLATE
Formula:
C9H8F3N5O2
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COMPUTED DESCRIPTORS
| Molecular Weight | 275.19 g/mol |
|---|---|
| XLogP3 | 1.4 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 9 |
| Rotatable Bond Count | 3 |
| Exact Mass | 275.06300900 g/mol |
| Monoisotopic Mass | 275.06300900 g/mol |
| Topological Polar Surface Area | 95.4 Ų |
| Heavy Atom Count | 19 |
| Formal Charge | 0 |
| Complexity | 353 |
| 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 |