338976-83-3
Product Name:
3-([2-(4-Chlorophenyl)(cyano)carbohydrazonoyl]sulfonyl)-5-methyl-4-isothiazolecarbonitrile
Formula:
C13H8ClN5O2S2
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COMPUTED DESCRIPTORS
| Molecular Weight | 365.8 g/mol |
|---|---|
| XLogP3 | 3.9 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 8 |
| Rotatable Bond Count | 4 |
| Exact Mass | 364.9807946 g/mol |
| Monoisotopic Mass | 364.9807946 g/mol |
| Topological Polar Surface Area | 156 Ų |
| Heavy Atom Count | 23 |
| Formal Charge | 0 |
| Complexity | 664 |
| 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 |