| CAS Number | 55478-78-9 |
| Catalog Number | AG00DKQL(AGN-PC-0WNPO1) |
| Chemical Name | 5-Bromo[1,2,4]triazolo[1,5-a]pyrazine |
| IUPAC Name | 5-bromo-[1,2,4]triazolo[1,5-a]pyrazine |
| InChI | InChI=1S/C5H3BrN4/c6-4-1-7-2-5-8-3-9-10(4)5/h1-3H |
| InChI Key | ZGVWVYMGLBYAKU-UHFFFAOYSA-N |
| MDL Number | MFCD21604036 |
| Molecular Formula | C5H3BrN4 |
| Molecular Weight | 199.0081 |
| SMILES | BrC1=CN=CC2=NC=NN21 |
| Synonyms | 55478-78-9,
5-bromo-[1,2,4]triazolo[1,5-a]pyrazine,
5-Bromo[1,2,4]triazolo[1,5-a]pyrazine,
SCHEMBL18358265,
ZINC88613751,
AKOS022182049,
NE53770,
AJ-128244,
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| Complexity | 131 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 197.954g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 199.011g/mol |
| Monoisotopic Mass | 197.954g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 43.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.7 |
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Certificate of Analysis
Lot Number