5,6-dimethylpyrimidine-4-carboxylic acid - CAS 933745-98-3
Catalog: |
BB040886 |
Product Name: |
5,6-dimethylpyrimidine-4-carboxylic acid |
CAS: |
933745-98-3 |
Synonyms: |
5,6-dimethyl-4-pyrimidinecarboxylic acid; 5,6-dimethylpyrimidine-4-carboxylic acid |
IUPAC Name: | 5,6-dimethylpyrimidine-4-carboxylic acid |
Description: | 5,6-dimethylpyrimidine-4-carboxylic acid (CAS# 933745-98-3) is a useful research chemical. |
Molecular Weight: | 152.153 |
Molecular Formula: | C7H8N2O2 |
Canonical SMILES: | CC1=C(N=CN=C1C)C(=O)O |
InChI: | InChI=1S/C7H8N2O2/c1-4-5(2)8-3-9-6(4)7(10)11/h3H,1-2H3,(H,10,11) |
InChI Key: | PXOZIDJACWTSFP-UHFFFAOYSA-N |
LogP: | 0.79160 |
Publication Number | Title | Priority Date |
US-2010331305-A1 | Oxo-heterocycle fused pyrimidine compounds, compositions and methods of use | 20090624 |
US-2009005359-A1 | Heterocyclic Compounds Useful as RAF Kinase Inhibitors | 20070629 |
US-2009036419-A1 | Compounds useful as raf kinase inhibitors | 20070629 |
US-2013065858-A1 | Compounds useful as raf kinase inhibitors | 20070629 |
US-2015080568-A1 | Compounds useful as raf kinase inhibitors | 20070629 |
Complexity: | 161 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 152.058577502 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 152.058577502 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 63.1 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.8 |
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