| CAS Number | 1356563-62-6 |
| Catalog Number | AG01F7J6(AGN-PC-3H497C) |
| Chemical Name | 7-Amino-5-phenylpyrazolo[1,5-a]pyrimidine-3-carbonitrile |
| IUPAC Name | 7-amino-5-phenylpyrazolo[1,5-a]pyrimidine-3-carbonitrile |
| InChI | InChI=1S/C13H9N5/c14-7-10-8-16-18-12(15)6-11(17-13(10)18)9-4-2-1-3-5-9/h1-6,8H,15H2 |
| InChI Key | OFOBESMNUFHZLF-UHFFFAOYSA-N |
| MDL Number | MFCD28166207 |
| Molecular Formula | C13H9N5 |
| Molecular Weight | 235.2441 |
| SMILES | N#Cc1cnn2c1nc(cc2N)c1ccccc1 |
| Synonyms | 7-amino-5-phenylpyrazolo[1,5-a]pyrimidine-3-carbonitrile,
1356563-62-6,
CHEMBL2062556,
BDBM50388796,
ZINC84704699,
|
| Complexity | 343 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 235.086g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 235.25g/mol |
| Monoisotopic Mass | 235.086g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 80A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number