3H,4H,5H,6H,7H,8H-pyrido[4,3-d]pyrimidin-4-one

Basic Information

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CAS Number

756437-41-9

Molecular Formula

C7H15Cl2N3O3

Molecular Weight

151.17 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

Basic Physical Properties

Boiling Point

418.6 ℃ at 760 mmHg

SMILES

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C1CNCC2=C1N=CNC2=O

InChI

InChI=1S/C7H9N3O/c11-7-5-3-8-2-1-6(5)9-4-10-7/h4,8H,1-3H2,(H,9,10,11)

InChIKey

XYYZKOFIMYHHAG-UHFFFAOYSA-N

LogP

-0.5843999999999998

Topological Polar Surface Area

57.78 Å²

Hydrogen Bond Donor/Acceptor

2 / 4

Complexity

254

Synonyms & References

English

AKOS015909438
DTXSID10547799
756437-41-9
XYYZKOFIMYHHAG-UHFFFAOYSA-N
A4268
5,6,7,8-Tetrahydro-3H-pyrido[4,3-d]pyrimidin-4-one
5,6,7,8-Tetrahydropyrido[4,3-d]pyrimidin-4(1H)-one
A838471
F1907-0488
J-516503
5,6,7,8-tetrahydro-1H-pyrido[4,3-d]pyrimidin-4-one
5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-4-one
AM101237
EN300-87434
3H,4H,5H,6H,7H,8H-pyrido[4,3-d]pyrimidin-4-one
5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-4-ol
BCP10164
FT-0648973
AKOS028109865
CS-D0338
CCG-344315
SCHEMBL996482
Pyrido[4,3-d]pyrimidin-4(1H)-one, 5,6,7,8-tetrahydro-
AKOS006229443
5,6,7,8-Tetrahydropyrido[4,3-d]pyrimidin-4(3H)-one
5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-4(3H)-one(HCl salt)
5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-4(3H)-onehydrochloride
Pyrido[4,3-d]pyrimidin-4(3H)-one, 5,6,7,8-tetrahydro-
5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-4(3H)-one(SALTDATA: 1.65HCl 1.5H2O)

MDL Number

MFCD08273930

FAQ

What regulatory guidelines apply to 3H,4H,5H,6H,7H,8H-pyrido[4,3-d]pyrimidin-4-one (CAS: 756437-41-9)?

3H,4H,5H,6H,7H,8H-pyrido[4,3-d]pyrimidin-4-one (CAS: 756437-41-9) requires adherence to the Globally Harmonized System of Classification and Labelling of Chemicals (GHS), REACH regulations in the European Union, and FDA/EPA guidelines for its manufacture, handling, and disposal. Ensuring compliance with local and international regulations is crucial to prevent environmental and health risks.

Are there alternatives to 3H,4H,5H,6H,7H,8H-pyrido[4,3-d]pyrimidin-4-one in synthesis?

While 3H,4H,5H,6H,7H,8H-pyrido[4,3-d]pyrimidin-4-one (CAS: 756437-41-9) is a valuable compound, alternatives include other pyrimidine derivatives and their analogs. Common alternatives in synthesis include using pyrimidine-2,4-dione as a starting material, which can be modified to fit the desired structure. These alternatives offer different reactivity and properties, making them suitable for various applications.

What is the market or research trend for 3H,4H,5H,6H,7H,8H-pyrido[4,3-d]pyrimidin-4-one (CAS: 756437-41-9)?

The market for 3H,4H,5H,6H,7H,8H-pyrido[4,3-d]pyrimidin-4-one (CAS: 756437-41-9) is growing due to its applications in pharmaceuticals and agrochemicals. Recent research trends focus on its use as a scaffold for drug discovery and as a component in pesticides. The compound's versatility and potential for further functionalization drive ongoing interest and investment in its development and application.

How should waste containing 3H,4H,5H,6H,7H,8H-pyrido[4,3-d]pyrimidin-4-one (CAS: 756437-41-9) be handled?

Waste containing 3H,4H,5H,6H,7H,8H-pyrido[4,3-d]pyrimidin-4-one (CAS: 756437-41-9) should be collected in appropriate containers and stored in a secure, well-ventilated area. Incineration or professional waste disposal services are recommended to ensure safe and environmentally sound disposal. Follow local environmental protection regulations to prevent contamination and protect public health.