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CS-W001157 4
Total: USD 88.00

(E)-2-Isopropyl-5-styrylbenzene-1,3-diol

  • CAS No. 79338-84-4

  • Cat. No. CS-0031487
  • Molecule weight254.32
  • Purity≥98%
  • MDL No.MFCD13193203

*For research and further manufacturing use only, not for direct human use.

(E)-2-Isopropyl-5-styrylbenzene-1,3-diol|CS-0031487

Structure of 79338-84-4

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General Information

  • CAS No. 79338-84-4
  • Cat. No. CS-0031487
  • Purity ≥98%
  • MDL No. MFCD13193203
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₇H₁₈O₂
  • Molecular Weight 254.32
  • Synonym(s) WBI-1001; Benvitimod; GSK2894512
  • SMILES OC1=C(C(C)C)C(O)=CC(/C=C/C2=CC=CC=C2)=C1

Description

Tapinarof is a non-steroidal, small-molecule therapeutic agent with potent anti-inflammatory and immunomodulatory properties. This compound features a unique tricyclic structure that enables selective modulation of cellular signaling pathways involved in skin inflammation. It demonstrates favorable stability and solubility under standard conditions, facilitating straightforward integration into topical formulations for dermatological applications.

Application

Tapinarof serves as a clinically validated small-molecule modulator of the aryl hydrocarbon receptor (AhR), enabling targeted regulation of inflammatory and oxidative stress pathways. Its pyridine-fused tricyclic core exhibits robust bench stability and compatibility with diverse functional groups, facilitating efficient synthesis of bioactive heterocyclic scaffolds. The compound functions as a reliable building block in medicinal chemistry workflows for developing therapeutics targeting dermatological and autoimmune conditions.

Safety Information

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GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

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Computational Chemistry Data

  • TPSA   40.46
  • LogP   4.3916
  • H_Acceptors   2
  • H_Donors   2
  • Rotatable_Bonds   3

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