4-Chloro-5-(trifluoromethyl)-1H-pyrrolo[2,3-b]pyridine - CAS 1196507-58-0
Catalog: |
BB004566 |
Product Name: |
4-Chloro-5-(trifluoromethyl)-1H-pyrrolo[2,3-b]pyridine |
CAS: |
1196507-58-0 |
Synonyms: |
4-chloro-5-(trifluoromethyl)-1H-pyrrolo[2,3-b]pyridine |
IUPAC Name: | 4-chloro-5-(trifluoromethyl)-1H-pyrrolo[2,3-b]pyridine |
Description: | 4-Chloro-5-(trifluoromethyl)-1H-pyrrolo[2,3-b]pyridine (CAS# 1196507-58-0) is a useful research chemical. |
Molecular Weight: | 220.58 |
Molecular Formula: | C8H4ClF3N2 |
Canonical SMILES: | C1=CNC2=NC=C(C(=C21)Cl)C(F)(F)F |
InChI: | InChI=1S/C8H4ClF3N2/c9-6-4-1-2-13-7(4)14-3-5(6)8(10,11)12/h1-3H,(H,13,14) |
InChI Key: | ATLADCFKPSZUNL-UHFFFAOYSA-N |
Purity: | 95 % |
MDL: | MFCD15529110 |
LogP: | 3.23510 |
Publication Number | Title | Priority Date |
WO-2020081848-A1 | Protein tyrosine phosphatase inhibitors | 20181017 |
EP-3867238-A1 | Protein tyrosine phosphatase inhibitors | 20181017 |
WO-2020081689-A1 | Azaindole inhibitors of wild-type and mutant forms of lrrk2 | 20181016 |
AU-2019362849-A1 | Azaindole inhibitors of wild-type and mutant forms of LRRK2 | 20181016 |
CN-112867493-A | Azaindole inhibitors of wild type and mutant LRRK2 | 20181016 |
Complexity: | 221 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 220.0015103 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 220.0015103 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 28.7 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.8 |
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