956626-42-9
Product Name:
N-[2-(1,3-DIMETHYL-4-NITRO-1H-PYRAZOL-5-YL)VINYL]-N-PHENYLAMINE
Formula:
C13H14N4O2
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 258.28 g/mol |
|---|---|
| XLogP3 | 2.5 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 3 |
| Exact Mass | 258.11167570 g/mol |
| Monoisotopic Mass | 258.11167570 g/mol |
| Topological Polar Surface Area | 75.7 Ų |
| Heavy Atom Count | 19 |
| Formal Charge | 0 |
| Complexity | 336 |
| 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 |