5-bromo-6-chloro-1H-pyrazolo[3,4-b]pyridine - CAS 1784380-03-5
Catalog: |
BB013466 |
Product Name: |
5-bromo-6-chloro-1H-pyrazolo[3,4-b]pyridine |
CAS: |
1784380-03-5 |
Synonyms: |
5-bromo-6-chloro-1H-pyrazolo[3,4-b]pyridine; 5-bromo-6-chloro-1H-pyrazolo[3,4-b]pyridine |
IUPAC Name: | 5-bromo-6-chloro-1H-pyrazolo[3,4-b]pyridine |
Description: | 5-bromo-6-chloro-1H-pyrazolo[3,4-b]pyridine (CAS# 1784380-03-5) is a useful research chemical. |
Molecular Weight: | 232.465 |
Molecular Formula: | C6H3BrClN3 |
Canonical SMILES: | C1=C2C=NNC2=NC(=C1Br)Cl |
InChI: | InChI=1S/C6H3BrClN3/c7-4-1-3-2-9-11-6(3)10-5(4)8/h1-2H,(H,9,10,11) |
InChI Key: | WWMXUPWIWJIDBM-UHFFFAOYSA-N |
LogP: | 2.37380 |
Publication Number | Title | Priority Date |
WO-2020247160-A1 | Condensed tryciclic pyrroles as alpha-1 antitrypsin modulators | 20190514 |
WO-2020081257-A1 | Modulators of alpha-1 antitrypsin | 20181005 |
TW-202024091-A | Modulators of alpha-1 antitrypsin | 20181005 |
US-2021179587-A1 | Modulators of alpha-1 antitrypsin | 20181005 |
Complexity: | 157 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 230.91989 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 230.91989 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 41.6 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.5 |
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