Lot numbers can be found on the outside label of a product:
Rosuvastatin impurity 52
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CAS No. 147118-36-3
- Cat. No. CS-0154297
- Purity≥97%
- MDL No.MFCD08063917
*For research and further manufacturing use only, not for direct human use.
Structure of 147118-36-3
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General Information
- CAS No. 147118-36-3
- Cat. No. CS-0154297
- Purity ≥97%
- MDL No. MFCD08063917
- Storage 4°C
- Shipping Room temperature in continental US; may vary elsewhere.
- Molecular Formula C₁₆H₂₀FN₃O₃S
- Molecular Weight 353.41
- Synonym(s) None
- SMILES O=S(=O)(N(C=1N=C(C=2C=CC(F)=CC2)C(=C(N1)C(C)C)CO)C)C
Description
This pyrimidine derivative features a fluorinated phenyl group, an isopropyl substituent, and a sulfonamide-functionalized side chain, delivering enhanced solubility and metabolic stability. The methanol handle enables straightforward derivatization, while the electron-deficient pyrimidine core supports efficient coupling reactions. Ideal for medicinal chemistry campaigns requiring robust scaffold diversity.
Application
4-(4-Fluorophenyl)-6-isopropyl-2-[(N-methyl-N-methylsulfonyl)amino]pyrimidine-5-yl-methanol serves as a versatile pyrimidine-based building block for medicinal chemistry campaigns, enabling efficient access to kinase inhibitor scaffolds. Its benzylic alcohol functionality facilitates downstream derivatization via oxidation or substitution, while the fluorophenyl and isopropyl groups provide favorable lipophilic and steric profiles. The sulfonamide moiety enhances solubility and hydrogen-bonding capacity, contributing to target binding affinity. Bench-stable and compatible with standard purification protocols, this compound functions effectively in multi-step synthesis and fragment-based drug discovery workflows.
Synthesis
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Route1
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147118-30-7 - ~80%
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In-stock
147118-36-3
References
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YUHAN CORPORATION; JU, Hyun; JOUNG, Sang-Sun; YI, Hyun-Jik; KHOO, Ja-Heouk; LIM, Jong-Chul; KIM, Jae-Gyu Patent: WO2012/2741 A2, 2012 ; Location in patent: Page/Page column 18 ; WO 2012/002741 A2
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Route2
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1263475-93-9 - ~98%
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In-stock
147118-36-3
References
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Porton Fine Chemicals Ltd; LIN, Wenqing; ZHENG, Hongjie; YANG, Peng Patent: EP2602250 A1, 2013 ; Location in patent: Paragraph 0028; 0029 ;
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Route3
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In-stock
799842-07-2 - ~99%
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In-stock
147118-36-3
References
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Sterk, Damjan; Casar, Zdenko; Jukic, Marko; Kosmrlj, Janez Tetrahedron, 2012 , vol. 68, # 9 p. 2155 - 2160
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Safety Information
Download SDS|
GHS Pictogram :
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GHS No : GHS07
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Signal Word : Warning
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UN#: N/A
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Class : N/A
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Packing Group : N/A
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Hazard Statements : H302-H315-H319-H335
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Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P405-P501
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Quality Control
Computational Chemistry Data
- TPSA 83.39
- LogP 2.2942
- H_Acceptors 5
- H_Donors 1
- Rotatable_Bonds 5
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Key Words
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