1025214-94-1
Product Name:
2-(5-METHYL(3-HYDROBENZIMIDAZOL-2-YLIDENE))-2-((4-(TRIFLUOROMETHOXY)PHENYL)SULFONYL)ETHANENITRILE
Formula:
C17H12F3N3O3S
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COMPUTED DESCRIPTORS
| Molecular Weight | 395.4 g/mol |
|---|---|
| XLogP3 | 4.1 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 9 |
| Rotatable Bond Count | 3 |
| Exact Mass | 395.05514691 g/mol |
| Monoisotopic Mass | 395.05514691 g/mol |
| Topological Polar Surface Area | 99.6 Ų |
| Heavy Atom Count | 27 |
| Formal Charge | 0 |
| Complexity | 743 |
| 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 |