6-Methyl-4-oxo-1,4-dihydroquinoline-3-carboxylic acid - CAS 51726-39-7
Catalog: |
BB027565 |
Product Name: |
6-Methyl-4-oxo-1,4-dihydroquinoline-3-carboxylic acid |
CAS: |
51726-39-7 |
Synonyms: |
6-methyl-4-oxo-1H-quinoline-3-carboxylic acid |
IUPAC Name: | 6-methyl-4-oxo-1H-quinoline-3-carboxylic acid |
Description: | 6-Methyl-4-oxo-1,4-dihydroquinoline-3-carboxylic acid (CAS# 51726-39-7) is a useful research chemical. |
Molecular Weight: | 203.19 |
Molecular Formula: | C11H9NO3 |
Canonical SMILES: | CC1=CC2=C(C=C1)NC=C(C2=O)C(=O)O |
InChI: | InChI=1S/C11H9NO3/c1-6-2-3-9-7(4-6)10(13)8(5-12-9)11(14)15/h2-5H,1H3,(H,12,13)(H,14,15) |
InChI Key: | MBHYBSDKDMRZAA-UHFFFAOYSA-N |
Purity: | 95 % |
LogP: | 1.53470 |
Publication Number | Title | Priority Date |
US-2017066722-A1 | Agents for use in the treatment of cardiovascular and inflammatory diseases structurally based on 4(1 h)-quinolone | 20140521 |
WO-2012148540-A1 | Combination of kanase inhibitors and uses threof | 20110223 |
US-2012309758-A1 | Modulators of atp-binding cassette transporters | 20101210 |
US-8802700-B2 | Modulators of ATP-Binding Cassette transporters | 20101210 |
EP-2590975-B1 | Indolizine derivatives, process for the preparation thereof and therapeutic use thereof | 20100706 |
PMID | Publication Date | Title | Journal |
17064064 | 20061102 | Evaluation of 3-carboxy-4(1H)-quinolones as inhibitors of human protein kinase CK2 | Journal of medicinal chemistry |
Complexity: | 335 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 203.058243149 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 203.058243149 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 66.4 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.2 |
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Quinoline/Isoquinoline
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