6-(Boc-amino)-3-pyridazinecarboxylic Acid - CAS 301548-08-3
Catalog: |
BB020472 |
Product Name: |
6-(Boc-amino)-3-pyridazinecarboxylic Acid |
CAS: |
301548-08-3 |
Synonyms: |
6-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-pyridazinecarboxylic acid; 6-[(2-methylpropan-2-yl)oxycarbonylamino]pyridazine-3-carboxylic acid |
IUPAC Name: | 6-[(2-methylpropan-2-yl)oxycarbonylamino]pyridazine-3-carboxylic acid |
Description: | 6-(Boc-amino)-3-pyridazinecarboxylic Acid can be used to treat inflammatory disorders. |
Molecular Weight: | 239.23 |
Molecular Formula: | C10H13N3O4 |
Canonical SMILES: | CC(C)(C)OC(=O)NC1=NN=C(C=C1)C(=O)O |
InChI: | InChI=1S/C10H13N3O4/c1-10(2,3)17-9(16)11-7-5-4-6(8(14)15)12-13-7/h4-5H,1-3H3,(H,14,15)(H,11,13,16) |
InChI Key: | OHXXYXPEHSXQOR-UHFFFAOYSA-N |
LogP: | 0.94370 |
Publication Number | Title | Priority Date |
AU-2776500-A | New aminotriazole compounds, a process for their preparation and pharmaceutical compositions containing them | 19990415 |
AU-761586-B2 | New aminotriazole compounds, a process for their preparation and pharmaceutical compositions containing them | 19990415 |
CN-1145616-C | Novel amino-triazole compound, its preparation method and drug composition containing them | 19990415 |
CN-1272493-A | Novel amino-triazole compound, its preparation method and drug composition containing them | 19990415 |
EA-003023-B1 | NEW CONNECTIONS OF AMINOTRIAZOL, METHOD OF THEIR PRODUCTION AND CONTAINING THEIR PHARMACEUTICAL COMPOSITIONS | 19990415 |
Complexity: | 300 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 239.0906059 |
Formal Charge: | 0 |
Heavy Atom Count: | 17 |
Hydrogen Bond Acceptor Count: | 6 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 239.0906059 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 101 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.6 |
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