946386-74-9
Product Name:
3-((4,5-DICHLOROIMIDAZOLYL)METHYL)-4-BROMO-2-METHYL-1-PHENYL-3-PYRAZOLIN-5-ONE
Formula:
C14H11BrCl2N4O
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 402.1 g/mol |
|---|---|
| XLogP3 | 4.1 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 3 |
| Exact Mass | 399.94933 g/mol |
| Monoisotopic Mass | 399.94933 g/mol |
| Topological Polar Surface Area | 41.4 Ų |
| Heavy Atom Count | 22 |
| Formal Charge | 0 |
| Complexity | 484 |
| 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 |