551921-18-7
Product Name:
N-METHYL-2-([3-(3-PYRIDINYL)-6-(TRIFLUOROMETHYL)THIENO[3,2-B]PYRIDIN-2-YL]CARBONYL)-1-HYDRAZINECARBOTHIOAMIDE
Formula:
C16H12F3N5OS2
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COMPUTED DESCRIPTORS
| Molecular Weight | 411.4 g/mol |
|---|---|
| XLogP3 | 2.9 |
| Hydrogen Bond Donor Count | 3 |
| Hydrogen Bond Acceptor Count | 8 |
| Rotatable Bond Count | 2 |
| Exact Mass | 411.04353686 g/mol |
| Monoisotopic Mass | 411.04353686 g/mol |
| Topological Polar Surface Area | 139 Ų |
| Heavy Atom Count | 27 |
| Formal Charge | 0 |
| Complexity | 565 |
| 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 |