3-Methyl-1-phenyl-6-(pyridin-3-yl)-1H-pyrazolo[3,4-b]pyridine-4-carboxylic acid - CAS 1011397-14-0
Catalog: |
BB047913 |
Product Name: |
3-Methyl-1-phenyl-6-(pyridin-3-yl)-1H-pyrazolo[3,4-b]pyridine-4-carboxylic acid |
CAS: |
1011397-14-0 |
Synonyms: |
3-Methyl-1-phenyl-6-(3-pyridyl)pyrazolo[3,4-b]pyridine-4-carboxylic acid; 3-methyl-1-phenyl-6-(3-pyridyl)pyrazolo[5,4-b]pyridine-4-carboxylic acid |
IUPAC Name: | 3-methyl-1-phenyl-6-pyridin-3-ylpyrazolo[3,4-b]pyridine-4-carboxylic acid |
Description: | 3-Methyl-1-phenyl-6-(pyridin-3-yl)-1H-pyrazolo[3,4-b]pyridine-4-carboxylic acid (CAS# 1011397-14-0 ) is a useful research chemical. |
Molecular Weight: | 330.34 |
Molecular Formula: | C19H14N4O2 |
Canonical SMILES: | CC1=NN(C2=C1C(=CC(=N2)C3=CN=CC=C3)C(=O)O)C4=CC=CC=C4 |
InChI: | InChI=1S/C19H14N4O2/c1-12-17-15(19(24)25)10-16(13-6-5-9-20-11-13)21-18(17)23(22-12)14-7-3-2-4-8-14/h2-11H,1H3,(H,24,25) |
InChI Key: | XFBVGNJKOKKXGS-UHFFFAOYSA-N |
Purity: | 95 % |
Complexity: | 482 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 330.1116757 |
Formal Charge: | 0 |
Heavy Atom Count: | 25 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 330.1116757 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 80.9 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3 |
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