2-Bromo-4-methyl-5-nitropyridine - CAS 23056-47-5
Catalog: |
BB017892 |
Product Name: |
2-Bromo-4-methyl-5-nitropyridine |
CAS: |
23056-47-5 |
Synonyms: |
2-bromo-4-methyl-5-nitropyridine; 2-bromo-4-methyl-5-nitropyridine |
IUPAC Name: | 2-bromo-4-methyl-5-nitropyridine |
Description: | 2-Bromo-4-methyl-5-nitropyridine acts as a reagent for the synthetic preparation of azaindole hydroxamic acid as potent HIV-1 integrase inhibitors, discovery of 3,5-substituted 6-azaindazoles as potent pan-Pim inhibitors. |
Molecular Weight: | 217.02 |
Molecular Formula: | C6H5BrN2O2 |
Canonical SMILES: | CC1=CC(=NC=C1[N+](=O)[O-])Br |
InChI: | InChI=1S/C6H5BrN2O2/c1-4-2-6(7)8-3-5(4)9(10)11/h2-3H,1H3 |
InChI Key: | OSYUAHGEDKTDOX-UHFFFAOYSA-N |
Boiling Point: | 294.2 °C at 760 mmHg |
Density: | 1.709 g/cm3 |
MDL: | MFCD03095066 |
LogP: | 2.58390 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
US-2021078999-A1 | Plasma kallikrein inhibitors and uses thereof | 20190918 |
WO-2021055621-A1 | Plasma kallikrein inhibitors and uses thereof | 20190918 |
WO-2020167976-A1 | Thieno[3,2-b] pyrrole[3,2-d]pyridazinone derivatives and their use as pkm2 derivatives for the treatment of cancer, obesity and diabetes related disorders | 20190213 |
WO-2019236766-A1 | Methods of culturing and/or expanding stem cells and/or lineage committed progenitor cells using lactam compounds | 20180606 |
US-2021254006-A1 | Methods of culturing and/or expanding stem cells and/or lineage committed progenitor cells using lactam compounds | 20180606 |
Complexity: | 159 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 215.95344 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 215.95344 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 58.7 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.1 |
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Pyridines
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