6-bromo-3-methyl-3H-[1,2,3]triazolo[4,5-b]pyridine - CAS 1257554-00-9
Catalog: |
BB006251 |
Product Name: |
6-bromo-3-methyl-3H-[1,2,3]triazolo[4,5-b]pyridine |
CAS: |
1257554-00-9 |
Synonyms: |
6-bromo-3-methyltriazolo[4,5-b]pyridine; 6-bromo-3-methyltriazolo[4,5-b]pyridine |
IUPAC Name: | 6-bromo-3-methyltriazolo[4,5-b]pyridine |
Description: | 6-bromo-3-methyl-3H-[1,2,3]triazolo[4,5-b]pyridine (CAS# 1257554-00-9 ) is a useful research chemical. |
Molecular Weight: | 213.038 |
Molecular Formula: | C6H5BrN4 |
Canonical SMILES: | CN1C2=NC=C(C=C2N=N1)Br |
InChI: | InChI=1S/C6H5BrN4/c1-11-6-5(9-10-11)2-4(7)3-8-6/h2-3H,1H3 |
InChI Key: | MHWRXBLIXOUVOJ-UHFFFAOYSA-N |
MDL: | MFCD22628169 |
LogP: | 1.12580 |
Publication Number | Title | Priority Date |
US-2021078975-A1 | Fused cyclic urea derivatives as crhr2 antagonist | 20180409 |
AU-2014369153-A1 | Nrf2 regulators | 20131218 |
AU-2014369153-B2 | Nrf2 regulators | 20131218 |
AU-2017279668-A1 | Nrf2 regulators | 20131218 |
AU-2017279668-B2 | Nrf2 regulators | 20131218 |
Complexity: | 154 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 211.96976 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 211.96976 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 43.6 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.1 |
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