6-Bromo-7-methyl-1H-imidazo[4,5-b]pyridine - CAS 91996-63-3
Catalog: |
BB040406 |
Product Name: |
6-Bromo-7-methyl-1H-imidazo[4,5-b]pyridine |
CAS: |
91996-63-3 |
Synonyms: |
6-bromo-7-methyl-1H-imidazo[4,5-b]pyridine; 6-bromo-7-methyl-1H-imidazo[4,5-b]pyridine |
IUPAC Name: | 6-bromo-7-methyl-1H-imidazo[4,5-b]pyridine |
Description: | 6-Bromo-7-methyl-1H-imidazo[4,5-b]pyridine (CAS# 91996-63-3) is an intermediate used to prepare 6-methyl-7-deaza analog of adenosine that potently inhibits replication of Polio and Dengue viruses. |
Molecular Weight: | 212.05 |
Molecular Formula: | C7H6BrN3 |
Canonical SMILES: | CC1=C2C(=NC=C1Br)N=CN2 |
InChI: | InChI=1S/C7H6BrN3/c1-4-5(8)2-9-7-6(4)10-3-11-7/h2-3H,1H3,(H,9,10,11) |
InChI Key: | XVEGORLAVIFJMX-UHFFFAOYSA-N |
LogP: | 2.02880 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]; H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation] |
Precautionary Statement: | P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
AU-2018244935-A1 | Naphthyridines as inhibitors of HPK1 | 20170330 |
EP-3601284-A1 | Naphthyridines as inhibitors of hpk1 | 20170330 |
KR-20190136028-A | Naphthyridine as an HPK1 Inhibitor | 20170330 |
TW-201904964-A | Acridine as an inhibitor of HPK1 | 20170330 |
US-10407424-B2 | Naphthyridines as inhibitors of HPK1 | 20170330 |
Complexity: | 153 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 210.97451 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 210.97451 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 41.6 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.8 |
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