3-(5-Bromo-2-pyridyl)-3-oxetanol - CAS 1207758-80-2
Catalog: |
BB004971 |
Product Name: |
3-(5-Bromo-2-pyridyl)-3-oxetanol |
CAS: |
1207758-80-2 |
Synonyms: |
3-(5-bromo-2-pyridinyl)-3-oxetanol; 3-(5-bromopyridin-2-yl)oxetan-3-ol |
IUPAC Name: | 3-(5-bromopyridin-2-yl)oxetan-3-ol |
Description: | 3-(5-Bromo-2-pyridyl)-3-oxetanol (CAS# 1207758-80-2 ) is a useful research chemical. |
Molecular Weight: | 230.06 |
Molecular Formula: | C8H8BrNO2 |
Canonical SMILES: | C1C(CO1)(C2=NC=C(C=C2)Br)O |
InChI: | InChI=1S/C8H8BrNO2/c9-6-1-2-7(10-3-6)8(11)4-12-5-8/h1-3,11H,4-5H2 |
InChI Key: | TWHBBMSMSDZUQX-UHFFFAOYSA-N |
LogP: | 1.06190 |
Publication Number | Title | Priority Date |
WO-2021130259-A1 | Dihydrocyclopenta-isoquinoline-sulfonamide derivatives compounds | 20191223 |
EP-3628669-A1 | Novel compounds as nadph oxidase inhibitors | 20180928 |
WO-2020065048-A1 | Novel compounds as nadph oxidase inhibitors | 20180928 |
EP-3856736-A1 | Novel compounds as nadph oxidase inhibitors | 20180928 |
KR-20210069669-A | Novel compounds as NADPH oxidase inhibitors | 20180928 |
Complexity: | 172 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 228.97384 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 228.97384 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 42.4 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.2 |
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