| CAS Number | 1823227-35-5 |
| Catalog Number | AG01BHU6 |
| Chemical Name | 5-benzyl-4H,5H,6H,7H-pyrazolo[1,5-a]pyrazin-2-amine |
| IUPAC Name | 5-benzyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-2-amine |
| InChI | InChI=1S/C13H16N4/c14-13-8-12-10-16(6-7-17(12)15-13)9-11-4-2-1-3-5-11/h1-5,8H,6-7,9-10H2,(H2,14,15) |
| InChI Key | JNCRDCCWEWLFSB-UHFFFAOYSA-N |
| MDL Number | MFCD23381309 |
| Molecular Formula | C13H16N4 |
| Molecular Weight | 228.2929 |
| SMILES | NC1=NN2C(CN(CC2)CC2=CC=CC=C2)=C1 |
| Synonyms | 5-benzyl-4H,5H,6H,7H-pyrazolo[1,5-a]pyrazin-2-amine,
1823227-35-5,
|
| Complexity | 252 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 228.137g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 228.299g/mol |
| Monoisotopic Mass | 228.137g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 47.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number