5-Chloro-1-methyl-1H-imidazo[4,5-b]pyridin-2(3H)-one - CAS 40852-06-0
Catalog: |
BB024695 |
Product Name: |
5-Chloro-1-methyl-1H-imidazo[4,5-b]pyridin-2(3H)-one |
CAS: |
40852-06-0 |
Synonyms: |
5-chloro-1-methyl-3H-imidazo[4,5-b]pyridin-2-one; 5-chloro-1-methyl-3H-imidazo[4,5-b]pyridin-2-one |
IUPAC Name: | 5-chloro-1-methyl-3H-imidazo[4,5-b]pyridin-2-one |
Description: | 5-Chloro-1-methyl-1H-imidazo[4,5-b]pyridin-2(3H)-one (CAS# 40852-06-0) is a useful research chemical. |
Molecular Weight: | 183.60 |
Molecular Formula: | C7H6ClN3O |
Canonical SMILES: | CN1C2=C(NC1=O)N=C(C=C2)Cl |
InChI: | InChI=1S/C7H6ClN3O/c1-11-4-2-3-5(8)9-6(4)10-7(11)12/h2-3H,1H3,(H,9,10,12) |
InChI Key: | CRMDODRROWFDQK-UHFFFAOYSA-N |
LogP: | 0.00000 |
Publication Number | Title | Priority Date |
US-2020207764-A1 | Dihydrobenzimidazolones for medical treatment | 20170904 |
US-2014113824-A1 | Bicyclic (thio)carbonylamidines | 20110510 |
EP-2139478-A1 | Certain chemical entities, compositions and methods | 20070330 |
US-2008242695-A1 | Certain Chemical Entities, Compositions, and Methods | 20070330 |
US-7851484-B2 | Certain chemical entities, compositions, and methods | 20070330 |
Complexity: | 211 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 183.0199395 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 183.0199395 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 45.2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1 |
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