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8-oxo-5,6-dihydro-4H,8H-[1,2,5]oxadiazolo[3,4-c]pyrido[3,2,1-ij]quinolin-9-ium-9-olate structure
Fine Chemical

8-oxo-5,6-dihydro-4H,8H-[1,2,5]oxadiazolo[3,4-c]pyrido[3,2,1-ij]quinolin-9-ium-9-olate

TL;DR: 8-oxo-5,6-dihydro-4H,8H-[1,2,5]oxadiazolo[3,4-c]pyrido[3,2,1-ij]quinolin-9-ium-9-olate (CAS 141945-44-0) is a chemical compound with molecular formula C12H9N3O3 and molecular weight 243.06439 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

13-oxido-12-oxa-1,11-diaza-13-azoniatetracyclo[7.6.1.05,16.010,14]hexadeca-5(16),6,8,10,13-pentaen-15-one

Also Known As: 8-oxo-5,6-dihydro-4H,8H-[1,2,5]oxadiazolo[3,4-c]pyrido[3,2,1-ij]quinolin-9-ium-9-olate, 13-oxido-12-oxa-1,11-diaza-13-azoniatetracyclo[7.6.1.05,16.010,14]hexadeca-5(16),6,8,10,13-pentaen-15-one, 15-oxo-12-oxa-1,11,13-triazatetracyclo[7.6.1.0^{5,16}.0^{10,14}]hexadeca-5(16),6,8,10,13-pentaen-13-ium-13-olate, 9-Oxo-5,6-dihydro-4H,8H-9lambda~5~-[1,2,5]oxadiazolo[3,4-c]pyrido[3,2,1-ij]quinolin-8-one

CAS Number
141945-44-0
Molecular Formula
C12H9N3O3
Molecular Weight
243.06439 g/mol
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Technical Specifications

Molecular FormulaC12H9N3O3
Molecular Weight243.06439 g/mol
XLogP1.5
Topological Polar Surface Area (TPSA)71.8 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors4
Rotatable Bonds0
Exact Mass243.06439 Da
Heavy Atoms18
Complexity378.0
SMILESC1CC2=C3C(=CC=C2)C4=NO[N+](=C4C(=O)N3C1)[O-]
InChIKeyDPHKPCHJPXDGQB-UHFFFAOYSA-N

Chemical Property Profile of 8-oxo-5,6-dihydro-4H,8H-[1,2,5]oxadiazolo[3,4-c]pyrido[3,2,1-ij]quinolin-9-ium-9-olate

XLogP
1.5
TPSA (Topological Polar Surface Area)
71.8
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
4
Rotatable Bonds
0
Heavy Atoms
18
Complexity
378.0
Exact Mass
243.06439
Monoisotopic Mass
243.06439
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of 8-oxo-5,6-dihydro-4H,8H-[1,2,5]oxadiazolo[3,4-c]pyrido[3,2,1-ij]quinolin-9-ium-9-olate

The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 8-oxo-5,6-dihydro-4H,8H-[1,2,5]oxadiazolo[3,4-c]pyrido[3,2,1-ij]quinolin-9-ium-9-olate. The TPSA of 71.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 8-oxo-5,6-dihydro-4H,8H-[1,2,5]oxadiazolo[3,4-c]pyrido[3,2,1-ij]quinolin-9-ium-9-olate. Following Lipinski's Rule of Five, 8-oxo-5,6-dihydro-4H,8H-[1,2,5]oxadiazolo[3,4-c]pyrido[3,2,1-ij]quinolin-9-ium-9-olate has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of 8-oxo-5,6-dihydro-4H,8H-[1,2,5]oxadiazolo[3,4-c]pyrido[3,2,1-ij]quinolin-9-ium-9-olate?

The CAS number of 8-oxo-5,6-dihydro-4H,8H-[1,2,5]oxadiazolo[3,4-c]pyrido[3,2,1-ij]quinolin-9-ium-9-olate is 141945-44-0.

What is the molecular formula of 8-oxo-5,6-dihydro-4H,8H-[1,2,5]oxadiazolo[3,4-c]pyrido[3,2,1-ij]quinolin-9-ium-9-olate?

The molecular formula of 8-oxo-5,6-dihydro-4H,8H-[1,2,5]oxadiazolo[3,4-c]pyrido[3,2,1-ij]quinolin-9-ium-9-olate is C12H9N3O3.

What is the molecular weight of 8-oxo-5,6-dihydro-4H,8H-[1,2,5]oxadiazolo[3,4-c]pyrido[3,2,1-ij]quinolin-9-ium-9-olate?

The molecular weight of 8-oxo-5,6-dihydro-4H,8H-[1,2,5]oxadiazolo[3,4-c]pyrido[3,2,1-ij]quinolin-9-ium-9-olate is 243.06439 g/mol.

Where can I buy 8-oxo-5,6-dihydro-4H,8H-[1,2,5]oxadiazolo[3,4-c]pyrido[3,2,1-ij]quinolin-9-ium-9-olate?

You can request a quote for 8-oxo-5,6-dihydro-4H,8H-[1,2,5]oxadiazolo[3,4-c]pyrido[3,2,1-ij]quinolin-9-ium-9-olate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 8-oxo-5,6-dihydro-4H,8H-[1,2,5]oxadiazolo[3,4-c]pyrido[3,2,1-ij]quinolin-9-ium-9-olate?

Yes, CoreyChem provides custom synthesis services for 8-oxo-5,6-dihydro-4H,8H-[1,2,5]oxadiazolo[3,4-c]pyrido[3,2,1-ij]quinolin-9-ium-9-olate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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