1432660-47-3
Product Name:
AGI6780
Formula:
C21H18F3N3O3S2
Synonyms:
IDH2 Inhibitor, R140Q Somatic Mutant-Specific, AGI-6780 - CAS 1432660-47-3 - Calbiochem;Isocitrate Dehydrogenase 2 R140 Somatic Mutant Inhibitor, AGI6780;N-Cyclopropyl-4-(3-thienyl)-3-[[[[3-(trifluoromethyl)phenyl]amino]carbonyl]amino]-benzenesulfonamide
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COMPUTED DESCRIPTORS
| Molecular Weight | 481.5 g/mol |
|---|---|
| XLogP3 | 4.2 |
| Hydrogen Bond Donor Count | 3 |
| Hydrogen Bond Acceptor Count | 8 |
| Rotatable Bond Count | 6 |
| Exact Mass | 481.07416828 g/mol |
| Monoisotopic Mass | 481.07416828 g/mol |
| Topological Polar Surface Area | 124 Ų |
| Heavy Atom Count | 32 |
| Formal Charge | 0 |
| Complexity | 771 |
| 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 |