117080-28-1
Product Name:
1-(ISONICOTINYL)-4-(4-NITROPHENYL)-3-THIOSEMICARBAZIDE
Formula:
C13H11N5O3S
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COMPUTED DESCRIPTORS
| Molecular Weight | 317.33 g/mol |
|---|---|
| XLogP3 | 1.5 |
| Hydrogen Bond Donor Count | 3 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 2 |
| Exact Mass | 317.05826040 g/mol |
| Monoisotopic Mass | 317.05826040 g/mol |
| Topological Polar Surface Area | 144 Ų |
| Heavy Atom Count | 22 |
| Formal Charge | 0 |
| Complexity | 414 |
| 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 |