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CAS 69118-25-8

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1-[4-[3-[(8-Acetyl-2,3-dihydro-1,4-benzodioxin-5-yl)oxy]-2-hydroxypropyl]-1-piperazinyl]-3-(3,4,5-trimethoxyphenyl)-2-propen-1-one

Description:
The chemical substance known as 1-[4-[3-[(8-Acetyl-2,3-dihydro-1,4-benzodioxin-5-yl)oxy]-2-hydroxypropyl]-1-piperazinyl]-3-(3,4,5-trimethoxyphenyl)-2-propen-1-one, with the CAS number 69118-25-8, is a complex organic compound characterized by its multi-functional structure. It features a piperazine moiety, which is often associated with biological activity, and a propenone group that may contribute to its reactivity and potential applications in medicinal chemistry. The presence of multiple methoxy groups on the phenyl ring suggests enhanced lipophilicity, which can influence its pharmacokinetic properties. Additionally, the compound contains a benzodioxin structure, which is known for its potential in various therapeutic areas, including anti-inflammatory and anticancer activities. Its intricate arrangement of functional groups indicates that it may interact with biological targets, making it a candidate for further research in drug development. Overall, this compound exemplifies the complexity and diversity of synthetic organic molecules in the realm of pharmaceutical chemistry.
Formula:C29H36N2O9
InChI:InChI=1S/C29H36N2O9/c1-19(32)22-6-7-23(29-27(22)38-13-14-39-29)40-18-21(33)17-30-9-11-31(12-10-30)26(34)8-5-20-15-24(35-2)28(37-4)25(16-20)36-3/h5-8,15-16,21,33H,9-14,17-18H2,1-4H3
InChI key:InChIKey=SYFDPNLESAYNCB-UHFFFAOYSA-N
SMILES:C(C)(=O)C1=C2C(=C(OCC(CN3CCN(C(C=CC4=CC(OC)=C(OC)C(OC)=C4)=O)CC3)O)C=C1)OCCO2
Synonyms:
  • Cinepaxadil
  • Cinepaxadil [INN]
  • 1,4-Benzodioxin, 1-piperazineethanol deriv.
  • UNII-E052L8N506
  • alpha-(((8-Acetyl-1,4-benzodioxan-5-yl)oxy)methyl)-4-(3,4,5-trimethoxycinnamoyl)-1-piperazineethanol
  • 1-Piperazineethanol, α-[[(8-acetyl-2,3-dihydro-1,4-benzodioxin-5-yl)oxy]methyl]-4-[1-oxo-3-(3,4,5-trimethoxyphenyl)-2-propenyl]-
  • 1-[4-[3-[(8-Acetyl-2,3-dihydro-1,4-benzodioxin-5-yl)oxy]-2-hydroxypropyl]-1-piperazinyl]-3-(3,4,5-trimethoxyphenyl)-2-propen-1-one
  • 1-[8-(2-hydroxy-3-{4-[(2E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoyl]piperazin-1-yl}propoxy)-2,3-dihydro-1,4-benzodioxin-5-yl]ethanone
  • Cinepaxadilum [Latin]
  • 2-Propen-1-one, 1-[4-[3-[(8-acetyl-2,3-dihydro-1,4-benzodioxin-5-yl)oxy]-2-hydroxypropyl]-1-piperazinyl]-3-(3,4,5-trimethoxyphenyl)-
  • Cinepaxadilum
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