956183-52-1
Product Name:
1H-Pyrazole-4-carboxaldehyde, 5-[(4-bromophenyl)thio]-1,3-diphenyl-
Formula:
C22H15BrN2OS
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COMPUTED DESCRIPTORS
| Molecular Weight | 435.3 g/mol |
|---|---|
| XLogP3 | 6.1 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 5 |
| Exact Mass | 434.00885 g/mol |
| Monoisotopic Mass | 434.00885 g/mol |
| Topological Polar Surface Area | 60.2 Ų |
| Heavy Atom Count | 27 |
| Formal Charge | 0 |
| Complexity | 473 |
| 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 |