Tanzisertib | CAS No. 899805-25-5

Tanzisertib

Basic Information

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CAS Number

899805-25-5

Molecular Formula

C21H23F3N6O2

Molecular Weight

448.45 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Specialty Chemicals UV Stabilizers

Agricultural Chemicals Pesticides Herbicides

Laboratory Chemicals Research Chemicals Biochemical Reagents

Basic Physical Properties

Boiling Point

626.4±65.0°C at 760 mmHg

SMILES

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C1CC(CCC1NC2=NC=C3C(=N2)N(C(=N3)NC4=C(C=C(C=C4F)F)F)C5CCOC5)O

InChI

InChI=1S/C21H23F3N6O2/c22-11-7-15(23)18(16(24)8-11)28-21-27-17-9-25-20(26-12-1-3-14(31)4-2-12)29-19(17)30(21)13-5-6-32-10-13/h7-9,12-14,31H,1-6,10H2,(H,27,28)(H,25,26,29)/t12-,13-,14-/m0/s1

InChIKey

IBGLGMOPHJQDJB-IHRRRGAJSA-N

LogP

3.6640000000000024

Topological Polar Surface Area

97.12 Å²

Hydrogen Bond Donor/Acceptor

3 / 8

Complexity

618

Safety Information

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GHS Hazard Pictograms

H302

Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

Synonyms & References

English

4-[[9-[(3S)-oxolan-3-yl]-8-(2,4,6-trifluoroanilino)purin-2-yl]amino]cyclohexan-1-ol
TANZISERTIB
UNII-M5O06306UO
CHEMBL1950289
CC-930
Tanzisertib (USAN)
Tanzisertib [USAN]
3tti
trans-4-((9-((3S)-Tetrahydrofuran-3-yl)-8-((2,4,6-trifluorophenyl)amino)-9H-purin-2-yl)amino)cyclohexanol
Trans-4-({9-[(3s)-Tetrahydrofuran-3-Yl]-8-[(2,4,6-Trifluorophenyl)amino]-9h-Purin-2-Yl}amino)cyclohexanol
Tanzisertib(CC-930)
CC930
CC 930
M5O06306UO
Tanzisertib [USAN:INN]
GTPL9836
JNK 930
EX-A3
trans-4-[[9-[(3S)-Tetrahydro-3-furanyl]-8-[(2,4,6-trifluorophenyl)amino]-9H-purin-2-yl]amino]cyclohexanol (ACI)
Tanzisertib
ZB1592
(1S,4r)-4-((9-((S)-tetrahydrofuran-3-yl)-8-((2,4,6-trifluorophenyl)amino)-9H-purin-2-yl)amino)cyclohexan-1-ol
4-[[9-[(3s)-tetrahydro-3-furanyl]-8-[(2,4,6-trifluorophenyl)amino]-9h-purin-2-yl]amino]cyclohexanol
899805-25-5
EX-A3115
NSC800943
D10168
1629774-47-5
AKOS030525451
Cyclohexanol, 4-((9-((3S)-tetrahydro-3-furanyl)-8-((2,4,6-trifluorophenyl)amino)-9H-purin-2-yl)amino)-, trans-
DTXSID601025671

MDL Number

MFCD23160040

FAQ

What regulatory guidelines apply to Tanzisertib (CAS: 899805-25-5)?

Tanzisertib (CAS: 899805-25-5) should adhere to the Globally Harmonized System of Classification and Labelling of Chemicals (GHS), REACH regulations for European markets, and FDA/EPA guidelines for drug and chemical safety and handling. Ensure compliance with local and international regulations for product usage, storage, and disposal.

Are there alternatives to Tanzisertib (CAS: 899805-25-5) in synthesis?

Alternatives to Tanzisertib in synthesis include similar small molecule inhibitors with similar mechanisms of action. Common alternatives include isomers and analogs, such as specific structural modifications or related compounds. These can offer different selectivity or efficacy profiles, allowing for tailored synthesis approaches.

What is the market or research trend for Tanzisertib (CAS: 899805-25-5)?

The market for Tanzisertib (CAS: 899805-25-5) is growing due to its potential in treating various diseases, particularly cancer. Research trends are focusing on its efficacy, safety, and broader applications. Market demand is likely to increase with advancements in clinical trials and regulatory approvals.

How should waste containing Tanzisertib (CAS: 899805-25-5) be handled?

Waste containing Tanzisertib (CAS: 899805-25-5) should be collected in appropriate containers, labeled clearly, and stored under controlled conditions. For disposal, it is advisable to use professional waste disposal services that comply with local regulations. Environmental protection measures should include proper incineration or secure landfill disposal to prevent environmental contamination.