477710-19-3
Product Name:
2-[(E)-2-(2-NITROPHENYL)HYDRAZONO]-3-OXO-3-(3,4,5-TRIMETHYL-1H-PYRAZOL-1-YL)PROPANENITRILE
Formula:
C15H14N6O3
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COMPUTED DESCRIPTORS
| Molecular Weight | 326.31 g/mol |
|---|---|
| XLogP3 | 3.8 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 3 |
| Exact Mass | 326.11273833 g/mol |
| Monoisotopic Mass | 326.11273833 g/mol |
| Topological Polar Surface Area | 129 Ų |
| Heavy Atom Count | 24 |
| Formal Charge | 0 |
| Complexity | 578 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |