338749-68-1
Product Name:
5-ACETYL-2-(([3-(4-METHOXYPHENYL)-5-ISOXAZOLYL]METHYL)AMINO)-6-METHYLNICOTINONITRILE
Formula:
C20H18N4O3
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COMPUTED DESCRIPTORS
| Molecular Weight | 362.4 g/mol |
|---|---|
| XLogP3 | 3.1 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 6 |
| Exact Mass | 362.13789045 g/mol |
| Monoisotopic Mass | 362.13789045 g/mol |
| Topological Polar Surface Area | 101 Ų |
| Heavy Atom Count | 27 |
| Formal Charge | 0 |
| Complexity | 555 |
| 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 |