1032296-44-8
Product Name:
4-[(3,5-Dimethyl-1H-pyrazol-4-yl)methyl]-5-ethylisoxazole-3-carboxylic acid
Formula:
C12H15N3O3
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COMPUTED DESCRIPTORS
| Molecular Weight | 249.27 g/mol |
|---|---|
| XLogP3 | 2.1 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 4 |
| Exact Mass | 249.11134135 g/mol |
| Monoisotopic Mass | 249.11134135 g/mol |
| Topological Polar Surface Area | 92 Ų |
| Heavy Atom Count | 18 |
| Formal Charge | 0 |
| Complexity | 313 |
| 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 |