CD Skripsi

Sintesis Dan Studi Molecular Docking Senyawa 4-(1-(4-Fluorofenil)-5-(3-Metoksifenil)-4,5-Dihidro-1h-Pirazol-3-Il) Fenol Sebagai Antikanker Payudara

---

Pyrazoline has two nitrogen atoms adjacent to each other in its ring and possess only one endocyclic double bond. This compound has bioactivity such as antibacterial, antitumor, antidiabetic, anti-inflammatory and anticancer and others. Pyrazoline, which has functional groups such as chloro, fluoro, bromo, and methoxy, has various pharmacological activities, such as being an anticancer agent. The pyrazoline compound 4-(1-(4-Fluorophenyl)-5-(3-Methoxyphenyl)-4,5-Dihydro-1H-Pirazol-3-yl) phenol and named as P3OME-4OH-4F has been successfully synthesized through three stages reaction. The first stage is the formation of the chalcone compound (10) through the Claisen-Schmidt condensation reaction, the second stage is the formation of the hydrazine compound (13) through diazotation and reduction reactions and the third stage is the formation of the P3OME-4OH-4F compound (14) through the cyclization reaction with each yields of 54%, 84% and 52%. The purity analysis of each synthesized compound was conducted using techniques such as thin-layer chromatography (TLC), determination of melting points, and high-performance liquid chromatography (HPLC). Based on spectroscopy data of UV, FTIR, LC-MS, 1H-NMR, and 13C-NMR, the P3OME-4OH-4F compound was confirmed to match the intended structure. The P3OME-4OH-4F compound showed remarkable efficacy in in-silico bioactivity analysis through the molecular docking method as an inhibitor of alpha-estrogen protein (ER-α). It exhibited more potent values for binding free energy (ΔG) and inhibition constant (Ki) than its positive control which the values were -9,9 kcal/mol and 0,0548 µM for P3OME-4OH-4F, whereas they were -9,3 kcal/mol and 0,151 µM for 4-hydroxytamoxifen. 

---

Ketersediaan

Informasi Detail

Judul Seri

-

No. Panggil

1903156181

Penerbit

Pekanbaru : Universitas Riau – FMIPA – Kimia., 2024

Deskripsi Fisik

-

Bahasa

Indonesia

ISBN/ISSN

-

Klasifikasi

1903156181

Tipe Isi

-

Tipe Media

-

Tipe Pembawa

-

Edisi

-

Subjek

KIMIA

Info Detail Spesifik

-

Pernyataan Tanggungjawab

Mutia

Versi lain/terkait

Lampiran Berkas

Komentar

---

Anda harus masuk sebelum memberikan komentar