6-Bromo-5-fluoro-1,2,3,4-tetrahydroisoquinoline - CAS 1781658-50-1
Catalog: |
BB013410 |
Product Name: |
6-Bromo-5-fluoro-1,2,3,4-tetrahydroisoquinoline |
CAS: |
1781658-50-1 |
Synonyms: |
6-bromo-5-fluoro-1,2,3,4-tetrahydroisoquinoline; 6-bromo-5-fluoro-1,2,3,4-tetrahydroisoquinoline |
IUPAC Name: | 6-bromo-5-fluoro-1,2,3,4-tetrahydroisoquinoline |
Description: | 6-Bromo-5-fluoro-1,2,3,4-tetrahydroisoquinoline (CAS# 1781658-50-1) is a useful research chemical. |
Molecular Weight: | 230.08 |
Molecular Formula: | C9H9BrFN |
Canonical SMILES: | C1CNCC2=C1C(=C(C=C2)Br)F |
InChI: | InChI=1S/C9H9BrFN/c10-8-2-1-6-5-12-4-3-7(6)9(8)11/h1-2,12H,3-5H2 |
InChI Key: | AUBCNXWUINQWCX-UHFFFAOYSA-N |
LogP: | 2.56270 |
Publication Number | Title | Priority Date |
WO-2021028645-A1 | Plasma kallikrein inhibitors | 20190809 |
WO-2021028649-A1 | Plasma kallikrein inhibitors | 20190809 |
EP-3463362-A1 | Substituted tetrahydroisoquinoline compounds useful as gpr120 agonists | 20160525 |
US-2019161448-A1 | Substituted tetrahydroisoquinoline compounds useful as gpr120 agonists | 20160525 |
WO-2017205193-A1 | Substituted tetrahydroisoquinoline compounds useful as gpr120 agonists | 20160525 |
Complexity: | 165 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 228.99024 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 228.99024 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 12 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.1 |
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Quinoline/Isoquinoline
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