861206-81-7
Product Name:
5-[(4-METHYLPHENYL)SULFONYL]-7-(TRIFLUOROMETHYL)-1,2,3,3A,4,5-HEXAHYDROPYRROLO[1,2-A]QUINOXALINE
Formula:
C19H19F3N2O2S
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COMPUTED DESCRIPTORS
| Molecular Weight | 396.4 g/mol |
|---|---|
| XLogP3 | 4.3 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 2 |
| Exact Mass | 396.11193351 g/mol |
| Monoisotopic Mass | 396.11193351 g/mol |
| Topological Polar Surface Area | 49 Ų |
| Heavy Atom Count | 27 |
| Formal Charge | 0 |
| Complexity | 640 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |