477710-12-6
Product Name:
3-(3,5-DIMETHYL-1H-PYRAZOL-1-YL)-2-[(Z)-2-(2-NITROPHENYL)HYDRAZONO]-3-OXOPROPANENITRILE
Formula:
C14H12N6O3
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COMPUTED DESCRIPTORS
| Molecular Weight | 312.28 g/mol |
|---|---|
| XLogP3 | 3.5 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 3 |
| Exact Mass | 312.09708827 g/mol |
| Monoisotopic Mass | 312.09708827 g/mol |
| Topological Polar Surface Area | 129 Ų |
| Heavy Atom Count | 23 |
| Formal Charge | 0 |
| Complexity | 549 |
| 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 |