57268-33-4
Product Name:
Dantrolene Related Compound B (50 mg) (5-(4-nitrophenyl)-2-furaldehyde-(2-carboxymethyl) semicarbazone)
Formula:
C14H12N4O6
Synonyms:
2-[1-(Aminocarbonyl)-2-[[5-(4-nitrophenyl)-2-furanyl]methylene]hydrazinyl]acetic acid;5-(4-Nitrophenyl)-2-furaldehyde-(2-carboxymethyl)semicarbazone
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COMPUTED DESCRIPTORS
| Molecular Weight | 332.27 g/mol |
|---|---|
| XLogP3 | 1.3 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 5 |
| Exact Mass | 332.07568412 g/mol |
| Monoisotopic Mass | 332.07568412 g/mol |
| Topological Polar Surface Area | 155 Ų |
| Heavy Atom Count | 24 |
| Formal Charge | 0 |
| Complexity | 512 |
| 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 |