AM-0902

Chemical Information
a TRPA1 antagonist; structure in first source
| CAS Number | 1883711-97-4 |
| PubChem CID | 73297271 |
| IUPAC Name | 1-[[3-[2-(4-chlorophenyl)ethyl]-1,2,4-oxadiazol-5-yl]methyl]-7-methylpurin-6-one |
| Molecular Formula | C17H15ClN6O2 |
| Molecular Weight | 370.8 |
| XLogP | 2.3 |
| Topological Polar Surface Area | 89.4 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 5 |
| Heavy Atom Count | 26 |
| Formal Charge | 0 |
| Complexity | 541 |
| Property | Value |
|---|---|
| Molecular Weight | 370.8 |
| XLogP3 | 2.3 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 5 |
| Exact Mass | 370.0945014 |
| Monoisotopic Mass | 370.0945014 |
| Topological Polar Surface Area | 89.4 Ų |
| Heavy Atom Count | 26 |
| Formal Charge | 0 |
| Complexity | 541 |
| 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 |
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