318238-03-8
Product Name:
METHYL 5-[(4-BROMOPHENYL)SULFANYL]-4-[(HYDROXYIMINO)METHYL]-1-PHENYL-1H-PYRAZOLE-3-CARBOXYLATE
Formula:
C18H14BrN3O3S
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COMPUTED DESCRIPTORS
| Molecular Weight | 432.3 g/mol |
|---|---|
| XLogP3 | 4.9 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 6 |
| Exact Mass | 430.99393 g/mol |
| Monoisotopic Mass | 430.99393 g/mol |
| Topological Polar Surface Area | 102 Ų |
| Heavy Atom Count | 26 |
| Formal Charge | 0 |
| Complexity | 496 |
| 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 |