321553-58-6
Product Name:
5-[(2-CHLOROBENZYL)SULFANYL]-4-(([(CYCLOPROPYLCARBONYL)OXY]IMINO)METHYL)-1-METHYL-3-(TRIFLUOROMETHYL)-1H-PYRAZOLE
Formula:
C17H15ClF3N3O2S
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COMPUTED DESCRIPTORS
| Molecular Weight | 417.8 g/mol |
|---|---|
| XLogP3 | 4.4 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 8 |
| Rotatable Bond Count | 7 |
| Exact Mass | 417.0525601 g/mol |
| Monoisotopic Mass | 417.0525601 g/mol |
| Topological Polar Surface Area | 81.8 Ų |
| Heavy Atom Count | 27 |
| Formal Charge | 0 |
| Complexity | 562 |
| 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 |