2,3-Dihydro-[1,4]dioxino[2,3-c]pyridine-7-carboxylic Acid - CAS 527681-13-6
Catalog: |
BB027935 |
Product Name: |
2,3-Dihydro-[1,4]dioxino[2,3-c]pyridine-7-carboxylic Acid |
CAS: |
527681-13-6 |
Synonyms: |
2,3-dihydro-[1,4]dioxino[2,3-c]pyridine-7-carboxylic acid; 2,3-dihydro-[1,4]dioxino[2,3-c]pyridine-7-carboxylic acid |
IUPAC Name: | 2,3-dihydro-[1,4]dioxino[2,3-c]pyridine-7-carboxylic acid |
Description: | 2,3-Dihydro-[1,4]dioxino[2,3-c]pyridine-7-carboxylic Acid (CAS# 527681-13-6) is a useful research chemical. |
Molecular Weight: | 181.15 |
Molecular Formula: | C8H7NO4 |
Canonical SMILES: | C1COC2=CN=C(C=C2O1)C(=O)O |
InChI: | InChI=1S/C8H7NO4/c10-8(11)5-3-6-7(4-9-5)13-2-1-12-6/h3-4H,1-2H2,(H,10,11) |
InChI Key: | BECXPUGKIFYJJE-UHFFFAOYSA-N |
LogP: | 0.55100 |
Publication Number | Title | Priority Date |
WO-2019208509-A1 | Bicyclic heterocycle derivatives having selective bace1 inhibitory activity | 20180423 |
US-2021261561-A1 | Bicyclic heterocycle derivatives having selective bace1 inhibitory activity | 20180423 |
EP-3233087-B1 | Geminal substituted quinuclidine amide compounds as agonists of alpha-7 nicotinic acetylcholine receptors | 20141216 |
EP-3623371-A1 | Geminal substituted quinuclidine amide compounds as agonists of alpha-7 nicotinic acetylcholine receptors | 20141216 |
ES-2764660-T3 | Geminal substituted quinuclidine amide compounds as nicotinic alpha-7 acetylcholine receptor agonists | 20141216 |
Complexity: | 208 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 181.0375077 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 181.0375077 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 68.6 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.4 |
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