242471-87-0
Product Name:
2-((2-OXO-1-[3-(TRIFLUOROMETHYL)BENZYL]-1,2-DIHYDRO-3-PYRIDINYL)CARBONYL)-N-PHENYL-1-HYDRAZINECARBOTHIOAMIDE
Formula:
C21H17F3N4O2S
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COMPUTED DESCRIPTORS
| Molecular Weight | 446.4 g/mol |
|---|---|
| XLogP3 | 4.3 |
| Hydrogen Bond Donor Count | 3 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 4 |
| Exact Mass | 446.10243146 g/mol |
| Monoisotopic Mass | 446.10243146 g/mol |
| Topological Polar Surface Area | 106 Ų |
| Heavy Atom Count | 31 |
| Formal Charge | 0 |
| Complexity | 747 |
| 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 |