343375-68-8
Product Name:
3-[(2-CHLORO-6-FLUOROBENZYL)SULFONYL]-5-METHYL-4-ISOTHIAZOLECARBONITRILE
Formula:
C12H8ClFN2O2S2
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COMPUTED DESCRIPTORS
| Molecular Weight | 330.8 g/mol |
|---|---|
| XLogP3 | 2.9 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 3 |
| Exact Mass | 329.9699757 g/mol |
| Monoisotopic Mass | 329.9699757 g/mol |
| Topological Polar Surface Area | 107 Ų |
| Heavy Atom Count | 20 |
| Formal Charge | 0 |
| Complexity | 501 |
| 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 |