1,5-Naphthyridine - CAS 254-79-5
Catalog: |
BB018924 |
Product Name: |
1,5-Naphthyridine |
CAS: |
254-79-5 |
Synonyms: |
1,5-naphthyridine; 1,5-naphthyridine |
IUPAC Name: | 1,5-naphthyridine |
Description: | 1,5-Naphthyridine (CAS# 254-79-5) is used in the synthesis of an anti-influenza drug GS-4104. |
Molecular Weight: | 130.15 |
Molecular Formula: | C8H6N2 |
Canonical SMILES: | C1=CC2=C(C=CC=N2)N=C1 |
InChI: | InChI=1S/C8H6N2/c1-3-7-8(9-5-1)4-2-6-10-7/h1-6H |
InChI Key: | VMLKTERJLVWEJJ-UHFFFAOYSA-N |
Boiling Point: | 248.9 °C at 760 mmHg |
Density: | 1.183 g/cm3 |
MDL: | MFCD00039727 |
LogP: | 1.62980 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P310, P312, P321, P330, P332+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
CN-113324980-A | Closed bipolar electrode array and application thereof | 20210604 |
CN-113264876-A | Method for selectively catalyzing and hydrogenating aromatic heterocyclic compounds by non-hydrogen participation | 20210528 |
CN-112174944-A | Compound with dibenzo five-membered heterocycle as core and application thereof | 20200925 |
US-2021104678-A1 | Organic compound, electroluminescent material, and use thereof | 20200922 |
CN-112047941-A | Compound and application thereof in preparing medicine for treating diseases caused by high expression of Flt3/c-Met kinase | 20200914 |
PMID | Publication Date | Title | Journal |
24000170 | 20140301 | Naphthyridines as novel BET family bromodomain inhibitors | ChemMedChem |
23038027 | 20121121 | 1,8-Naphthyridine-2,7-diamine: a potential universal reader of Watson-Crick base pairs for DNA sequencing by electron tunneling | Organic & biomolecular chemistry |
22900966 | 20121022 | Exploring the role of water molecules for docking and receptor guided 3D-QSAR analysis of naphthyridine derivatives as spleen tyrosine kinase (Syk) inhibitors | Journal of chemical information and modeling |
23125782 | 20121001 | 4-Diphenyl-phosphanyl-1,5-naphthyridine | Acta crystallographica. Section E, Structure reports online |
22790292 | 20120907 | Novel multifunctional organic semiconductor materials based on 4,8-substituted 1,5-naphthyridine: synthesis, single crystal structures, opto-electrical properties and quantum chemistry calculation | Organic & biomolecular chemistry |
Complexity: | 99.8 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 130.053098200 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 130.053098200 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 25.8 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.3 |
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