Gefapixant (citrate)

Chemical Information
See also: Gefapixant (has active moiety).
| CAS Number | 2310299-91-1 |
| PubChem CID | 145720531 |
| IUPAC Name | 5-(2,4-diaminopyrimidin-5-yl)oxy-2-methoxy-4-propan-2-ylbenzenesulfonamide;2-hydroxypropane-1,2,3-tricarboxylic acid |
| Molecular Formula | C20H27N5O11S |
| Molecular Weight | 545.5 |
| Topological Polar Surface Area | 297 |
| Hydrogen Bond Donor Count | 7 |
| Hydrogen Bond Acceptor Count | 16 |
| Rotatable Bond Count | 10 |
| Heavy Atom Count | 37 |
| Formal Charge | 0 |
| Complexity | 739 |
| Property | Value |
|---|---|
| Molecular Weight | 545.5 |
| Hydrogen Bond Donor Count | 7 |
| Hydrogen Bond Acceptor Count | 16 |
| Rotatable Bond Count | 10 |
| Exact Mass | 545.14277787 |
| Monoisotopic Mass | 545.14277787 |
| Topological Polar Surface Area | 297 Ų |
| Heavy Atom Count | 37 |
| Formal Charge | 0 |
| Complexity | 739 |
| 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 | 2 |
| Compound Is Canonicalized | Yes |
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