477709-41-4
Product Name:
ETHYL (Z)-3-[(3-METHYL-1H-PYRAZOL-5-YL)AMINO]-2-(2,2,2-TRIFLUOROACETYL)-2-PROPENOATE
Formula:
C11H12F3N3O3
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COMPUTED DESCRIPTORS
| Molecular Weight | 291.23 g/mol |
|---|---|
| XLogP3 | 2.3 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 8 |
| Rotatable Bond Count | 5 |
| Exact Mass | 291.08307574 g/mol |
| Monoisotopic Mass | 291.08307574 g/mol |
| Topological Polar Surface Area | 87.6 Ų |
| Heavy Atom Count | 20 |
| Formal Charge | 0 |
| Complexity | 421 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 1 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |