1024174-13-7
Product Name:
1-(2-(3-CHLORO-5-(TRIFLUOROMETHYL)(2-PYRIDYLTHIO))ACETYL)-4-(4-(TRIFLUOROMETHOXY)PHENYL)THIOSEMICARBAZIDE
Formula:
C16H11ClF6N4O2S2
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COMPUTED DESCRIPTORS
| Molecular Weight | 504.9 g/mol |
|---|---|
| XLogP3 | 5.2 |
| Hydrogen Bond Donor Count | 3 |
| Hydrogen Bond Acceptor Count | 11 |
| Rotatable Bond Count | 5 |
| Exact Mass | 503.9916146 g/mol |
| Monoisotopic Mass | 503.9916146 g/mol |
| Topological Polar Surface Area | 133 Ų |
| Heavy Atom Count | 31 |
| Formal Charge | 0 |
| Complexity | 620 |
| 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 |