1-Ethyl-5-nitro-1H-indazole - CAS 5228-51-3
Catalog: |
BB027766 |
Product Name: |
1-Ethyl-5-nitro-1H-indazole |
CAS: |
5228-51-3 |
Synonyms: |
1-ethyl-5-nitroindazole; 1-ethyl-5-nitroindazole |
IUPAC Name: | 1-ethyl-5-nitroindazole |
Description: | 1-Ethyl-5-nitro-1H-indazole (CAS# 5228-51-3) is a useful research chemical compound. |
Molecular Weight: | 191.19 |
Molecular Formula: | C9H9N3O2 |
Canonical SMILES: | CCN1C2=C(C=C(C=C2)[N+](=O)[O-])C=N1 |
InChI: | InChI=1S/C9H9N3O2/c1-2-11-9-4-3-8(12(13)14)5-7(9)6-10-11/h3-6H,2H2,1H3 |
InChI Key: | OMCQGSFMKUKHLW-UHFFFAOYSA-N |
LogP: | 2.48760 |
Publication Number | Title | Priority Date |
EP-3672971-A1 | Triazolo pyridines as modulators of gamma-secretase | 20171219 |
CN-111465603-A | Triazolopyridines as gamma-secretase modulators | 20171219 |
US-2021017173-A1 | Triazolo pyridines as modulators of gamma-secretase | 20171219 |
EP-3672971-B1 | Triazolo pyridines as modulators of gamma-secretase | 20171219 |
JP-6903825-B2 | Triazolopyridine as a modulator of γ-secretase | 20171219 |
Complexity: | 229 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 191.069476538 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 191.069476538 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 63.6 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.7 |
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Indazoles
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