Pyrimido[4,5-b]quinoline-2,4(1H,3H)-dione

Basic Information

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CAS Number

26908-38-3

Molecular Formula

C11H7N3O2

Molecular Weight

213.2 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

SMILES

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C1=CC=C2C(=C1)C=C3C(=N2)NC(=O)NC3=O

InChI

InChI=1S/C11H7N3O2/c15-10-7-5-6-3-1-2-4-8(6)12-9(7)13-11(16)14-10/h1-5H,(H2,12,13,14,15,16)

InChIKey

KWHWFTSHDPJOTG-UHFFFAOYSA-N

LogP

0.7646

Topological Polar Surface Area

78.61 Å²

Hydrogen Bond Donor/Acceptor

2 / 5

Complexity

331

Synonyms & References

English

CHEMBL1905125
Deazaflavin
NSC 106042
1H-pyrimido[4,5-b]quinoline-2,4-dione
MLS002703860
CS-0235609
BBA90838
SMR001570574
CHEBI:4342
1H,2H,3H,4H-PYRIMIDO[4,5-B]QUINOLINE-2,4-DIONE
NSC-106042
Q27106341
1H-pyrimido[4, 5-b]quinoline-2, 4-dione
26908-38-3
5-Deazaflavin
K2CC2RHC84
SCHEMBL5780165
Pyrimido(4,5-b)quinoline-2,4(1H,3H)-dione
KWHWFTSHDPJOTG-UHFFFAOYSA-N
pyrimido[4,5-b]quinolin-2,4(3h,10h)-dione
C01800
UNII-K2CC2RHC84
NSC106042
DTXSID10181415
Pyrimido[4,5-b]quinoline-2,4(1H,3H)-dione
EN300-1589278
1H,2H,3H,4H-pyrimido4,5-bquinoline-2,4-dione

MDL Number

MFCD24549434

FAQ

What regulatory guidelines apply to Pyrimido[4,5-b]quinoline-2,4(1H,3H)-dione (CAS: 26908-38-3)?

Pyrimido[4,5-b]quinoline-2,4(1H,3H)-dione (CAS: 26908-38-3) is regulated under the Globally Harmonized System of Classification and Labelling of Chemicals (GHS) and falls under category 4.2 for organic peroxides. In the European Union, it must comply with the Registration, Evaluation, Authorisation and Restriction of Chemicals (REACH) regulation. Additionally, it is subject to the United States Environmental Protection Agency (EPA) and the Food and Drug Administration (FDA) for safety and environmental standards.

Are there alternatives to Pyrimido[4,5-b]quinoline-2,4(1H,3H)-dione (CAS: 26908-38-3) in synthesis?

There are several alternatives to Pyrimido[4,5-b]quinoline-2,4(1H,3H)-dione (CAS: 26908-38-3) in synthesis, including other quinoline derivatives and pyrimidine analogs. Common substitutes include 2,4-dioxo-1,4-dihydro-1H-pyrimido[4,5-b]quinoline and 2,4-dioxo-1,4-dihydro-1H-pyrimido[5,4-b]quinoline, which can be used depending on the specific application and desired properties.

What is the market or research trend for Pyrimido[4,5-b]quinoline-2,4(1H,3H)-dione (CAS: 26908-38-3)?

The market for Pyrimido[4,5-b]quinoline-2,4(1H,3H)-dione (CAS: 26908-38-3) is growing due to its use in pharmaceuticals, particularly as an antifungal agent. Research trends indicate an increasing focus on its therapeutic potential in treating fungal infections. Additionally, it is being explored for its anticancer and antimicrobial properties, driving market interest and investment in related research.

How should waste containing Pyrimido[4,5-b]quinoline-2,4(1H,3H)-dione (CAS: 26908-38-3) be handled?

Waste containing Pyrimido[4,5-b]quinoline-2,4(1H,3H)-dione (CAS: 26908-38-3) should be managed according to local and national regulations. It is typically collected in sealed containers and disposed of through professional waste disposal services. Incineration is a common method, but care must be taken to ensure complete combustion and minimal environmental impact. Environmental protection measures should include proper containment to prevent soil and water contamination.