5-Methyl-6-oxo-1,6-dihydropyridine-3-carboxylic Acid - CAS 66909-27-1
Catalog: |
BB033139 |
Product Name: |
5-Methyl-6-oxo-1,6-dihydropyridine-3-carboxylic Acid |
CAS: |
66909-27-1 |
Synonyms: |
5-methyl-6-oxo-1H-pyridine-3-carboxylic acid; 5-methyl-6-oxo-1H-pyridine-3-carboxylic acid |
IUPAC Name: | 5-methyl-6-oxo-1H-pyridine-3-carboxylic acid |
Description: | 5-Methyl-6-oxo-1,6-dihydropyridine-3-carboxylic Acid (CAS# 66909-27-1) is a useful research chemical. |
Molecular Weight: | 153.14 |
Molecular Formula: | C7H7NO3 |
Canonical SMILES: | CC1=CC(=CNC1=O)C(=O)O |
InChI: | InChI=1S/C7H7NO3/c1-4-2-5(7(10)11)3-8-6(4)9/h2-3H,1H3,(H,8,9)(H,10,11) |
InChI Key: | RZMBPQCQDHMSEW-UHFFFAOYSA-N |
LogP: | 0.79380 |
Publication Number | Title | Priority Date |
WO-2021127265-A1 | Compounds and probes for imaging huntingtin protein | 20191218 |
WO-2019118932-A1 | Inhibitors of fibroblast activation protein | 20171215 |
EP-3723753-A1 | Inhibitors of fibroblast activation protein | 20171215 |
WO-2018066718-A1 | Therapeutic compounds | 20161004 |
EP-3471723-A1 | Hedgehog acyltransferase inhibitors and uses thereof | 20160616 |
Complexity: | 275 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 153.042593085 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 153.042593085 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 66.4 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -0.2 |
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