1-Cyclopentyl-3-(1H-pyrrolo[2,3-b]pyridin-5-yl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine

Basic Information

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CAS Number

1092788-83-4

Molecular Formula

C17H17N7

Molecular Weight

319.37 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Amines

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Basic Physical Properties

Physical State

No data available

Melting Point

No data available

Boiling Point

650.9±50.0 °C at 760 mmHg

Flash Point

347.4±30.1 °C

Solubility

DMSO: >10mg/mL

SMILES

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Nc1ncnc2c1c(nn2C1CCCC1)c1cnc2c(c1)cc[nH]2

InChI

InChI=1S/C17H17N7/c18-15-13-14(11-7-10-5-6-19-16(10)20-8-11)23-24(12-3-1-2-4-12)17(13)22-9-21-15/h5-9,12H,1-4H2,(H,19,20)(H2,18,21,22)

InChIKey

NVRXTLZYXZNATH-UHFFFAOYSA-N

LogP

3.0669000000000004

Topological Polar Surface Area

98.30000000000001 Å²

Hydrogen Bond Donor/Acceptor

3 / 7

Complexity

454

Safety Information

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GHS Hazard Pictograms

H302

Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

Synonyms & References

English

PP 121 *
1-cyclopentyl-3-(1H-pyrrolo[2,3-b]pyridin-5-yl)pyrazolo[3,4-d]pyrimidin-4-amine
PP121
1-Cyclopentyl-3-(1H-pyrrolo[2,3-b]pyridin-5-yl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine
KS1
PP-121
PP-121,PP 121
1-cyclopentyl-3-(1H-pyrrolo[2,3-b]pyridin-5-yl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine

MDL Number

MFCD12912434

FAQ

What regulatory guidelines apply to 1-Cyclopentyl-3-(1H-pyrrolo[2,3-b]pyridin-5-yl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine (CAS: 1092788-83-4)?

1-Cyclopentyl-3-(1H-pyrrolo[2,3-b]pyridin-5-yl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine is subject to various regulatory guidelines, including GHS classification for hazardous chemicals, REACH regulations for substances and mixtures, and FDA/EPA requirements for pharmaceutical and agricultural applications. Proper hazard communication and safety data sheets (SDS) must be provided to ensure safe handling and storage.

Are there alternatives to 1-Cyclopentyl-3-(1H-pyrrolo[2,3-b]pyridin-5-yl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine in synthesis?

While 1-Cyclopentyl-3-(1H-pyrrolo[2,3-b]pyridin-5-yl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine is a specific compound, there are alternative reagents and synthetic pathways that can be explored. For instance, analogs such as 1-phenyl-3-(1H-pyrrolo[2,3-b]pyridin-5-yl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine or isomers can be used depending on the desired properties. Substituting reagents like different amines or pyrimidine derivatives can also serve as viable alternatives.

What is the market or research trend for 1-Cyclopentyl-3-(1H-pyrrolo[2,3-b]pyridin-5-yl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine (CAS: 1092788-83-4)?

The market for 1-Cyclopentyl-3-(1H-pyrrolo[2,3-b]pyridin-5-yl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine is currently focused on pharmaceutical and chemical research. There is a growing interest in its potential as a therapeutic agent, particularly in oncology and autoimmune diseases. Research trends include investigations into its mechanisms of action and the development of more potent derivatives. The compound's unique structure makes it an attractive target for new drug discovery.

How should waste containing 1-Cyclopentyl-3-(1H-pyrrolo[2,3-b]pyridin-5-yl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine (CAS: 1092788-83-4) be handled?

Waste containing 1-Cyclopentyl-3-(1H-pyrrolo[2,3-b]pyridin-5-yl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine should be collected and disposed of according to local hazardous waste regulations. Proper waste management practices include the use of appropriate containers and labeling. Incineration is a common method for disposing of such waste, but it must be conducted in a controlled environment to minimize environmental impact. Additionally, professional disposal services may be necessary to ensure compliance with safety and environmental protection precautions.