| CAS Number | 1256486-26-6 |
| Catalog Number | AG01FC9E(AGN-PC-3H49LK) |
| Chemical Name | N-Hydroxy-3-(3H-imidazo[4,5-b]pyridin-2-yl)benzimidamide |
| IUPAC Name | N'-hydroxy-3-(1H-imidazo[4,5-b]pyridin-2-yl)benzenecarboximidamide |
| InChI | InChI=1S/C13H11N5O/c14-11(18-19)8-3-1-4-9(7-8)12-16-10-5-2-6-15-13(10)17-12/h1-7,19H,(H2,14,18)(H,15,16,17) |
| InChI Key | ACUWNHCIYUAHPN-UHFFFAOYSA-N |
| MDL Number | MFCD16658855 |
| Molecular Formula | C13H11N5O |
| Molecular Weight | 253.2593 |
| SMILES | O/N=C(/c1cccc(c1)c1nc2c([nH]1)nccc2)\N |
| Synonyms | 3-(7-Aza-2-benzimidazolyl)benzamidoxime,
1256486-26-6,
MFCD16658855,
|
| Complexity | 348 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 1 |
| Exact Mass | 253.096g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 19 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 253.265g/mol |
| Monoisotopic Mass | 253.096g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 100A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.5 |
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Certificate of Analysis
Lot Number