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CAS 414910-27-3

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Casopitant

Description:
Casopitant, with the CAS number 414910-27-3, is a selective neurokinin-1 (NK1) receptor antagonist. It is primarily investigated for its potential use in the treatment of nausea and vomiting associated with chemotherapy, as well as for other conditions related to anxiety and depression. Casopitant works by blocking the action of substance P, a neuropeptide involved in the transmission of pain and the regulation of mood and stress responses. The compound is characterized by its ability to penetrate the blood-brain barrier, which is crucial for its effectiveness in central nervous system applications. In terms of its chemical structure, casopitant features a complex arrangement of functional groups that contribute to its pharmacological properties. It is typically administered orally and has been studied in various clinical trials to assess its efficacy and safety profile. Overall, casopitant represents a significant advancement in the development of therapies targeting the NK1 receptor pathway.
Formula:C30H35F7N4O2
InChI:InChI=1S/C30H35F7N4O2/c1-18-13-24(31)5-6-26(18)27-17-25(40-11-9-39(10-12-40)20(3)42)7-8-41(27)28(43)38(4)19(2)21-14-22(29(32,33)34)16-23(15-21)30(35,36)37/h5-6,13-16,19,25,27H,7-12,17H2,1-4H3/t19-,25+,27-/m1/s1
InChI key:InChIKey=XGGTZCKQRWXCHW-WMTVXVAQSA-N
SMILES:C(N([C@H](C)C1=CC(C(F)(F)F)=CC(C(F)(F)F)=C1)C)(=O)N2[C@H](C[C@H](CC2)N3CCN(C(C)=O)CC3)C4=C(C)C=C(F)C=C4
Synonyms:
  • 1-Piperidinecarboxamide, 4-(4-acetyl-1-piperazinyl)-N-[(1R)-1-[3,5-bis(trifluoromethyl)phenyl]ethyl]-2-(4-fluoro-2-methylphenyl)-N-methyl-, (2R,4S)-
  • 4-(S)-(4-Acetylpiperazin-1-yl)-2-(R)-(4-fluoro-2-methylphenyl)piperidine-1-carboxylic acid N-[1-(R)-(3,5-bis-trifluoromethylphenyl)ethyl]-N-methylamide
  • Casopitant
  • (2R,4S)-4-(4-Acetyl-1-piperazinyl)-N-[(1R)-1-[3,5-bis(trifluoromethyl)phenyl]ethyl]-2-(4-fluoro-2-methylphenyl)-N-methyl-1-piperidinecarboxamide
  • [14C]-Casopitant
  • GW 679769; GW-679769
  • Casopitant free base
  • GW679769 (Casopitant)
  • N-MethylaMide
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  • Casopitant
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    Casopitant

    CAS:
    <p>Casopitant (GW679769) is an orally active neurokinin-1 (NK1) receptor antagonist, researched for its potential use in managing chemotherapy-induced nausea and vomiting (CINV) and postoperative nausea and vomiting (PONV).</p>
    Formula:C30H35F7N4O2
    Color and Shape:Solid
    Molecular weight:616.61

    Ref: TM-T203625