| CAS Number | 1965308-70-6 |
| Catalog Number | AG01F6JQ(AGN-PC-3H495K) |
| Chemical Name | 5-Phenyl-7-hydroxypyrazolo[1,5-a]pyrimidine-3-carboxamidoxime |
| IUPAC Name | N'-hydroxy-7-oxo-5-phenyl-1H-pyrazolo[1,5-a]pyrimidine-3-carboximidamide |
| InChI | InChI=1S/C13H11N5O2/c14-12(17-20)9-7-15-18-11(19)6-10(16-13(9)18)8-4-2-1-3-5-8/h1-7,15,20H,(H2,14,17) |
| InChI Key | HKJFPIMBFUWJTJ-UHFFFAOYSA-N |
| MDL Number | MFCD28166206 |
| Molecular Formula | C13H11N5O2 |
| Molecular Weight | 269.2587 |
| SMILES | O/N=C(/c1cnn2c1nc(cc2O)c1ccccc1)\N |
| Synonyms | 5-Phenyl-7-hydroxypyrazolo[1,5-a]pyrimidine-3-carboxamidoxime,
1965308-70-6,
|
| Complexity | 555 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 1 |
| Exact Mass | 269.091g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 20 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 269.264g/mol |
| Monoisotopic Mass | 269.091g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 103A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.6 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number