Ezetimibe

CAS 163222-33-1  ·  C24H21F2NO3  ·  MW 409.4 g/mol

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3D model Ezetimibe, CAS 163222-33-1, molecular formula C24H21F2NO3, molar mass 409.4 g/mol
About Ezetimibe

Ezetimibe is a chemical compound registered under number CAS 163222-33-1, with the molecular formula C24H21F2NO3, and a molar mass of 409.4 g/mol.

The molecule contains 51 atoms connected by 54 chemical bonds. The full systematic IUPAC name of this compound is (3R,4S)-1-(4-fluorophenyl)-3-[(3S)-3-(4-fluorophenyl)-3-hydroxypropyl]-4-(4-hydroxyphenyl)azetidin-2-one. The interactive 3D model above lets you view the spatial arrangement of the atoms — you can rotate it with the mouse, zoom with the scroll wheel, and switch between skeletal / Ball & Stick / Space Fill visualization modes.

In terms of physicochemical properties, the partition coefficient logP = 4 (positive value, a lipophilic compound), polar surface area PSA = 60.8 Ų, 2 donors and 5 hydrogen bond acceptors. These parameters are key when assessing bioavailability and interaction with biomolecules.

Chemical data for this compound comes from PubChem (NIH NLM NCBI), one of the world's largest chemical databases. All information is updated automatically and enriched with GHS hazard statement translations compliant with the CLP Regulation (EC 1272/2008). The widget above may be used for educational, research and commercial purposes.

Physicochemical properties
Molecular formulaC24H21F2NO3
Masa molowa409.4 g/mol
IUPAC(3R,4S)-1-(4-fluorophenyl)-3-[(3S)-3-(4-fluorophenyl)-3-hydroxypropyl]-4-(4-hydroxyphenyl)azetidin-2-one
SMILESC1=CC(=CC=C1[C@@H]2[C@H](C(=O)N2C3=CC=C(C=C3)F)CC[C@@H](C4=CC=C(C=C4)F)O)O
InChIKeyOLNTVTPDXPETLC-XPWALMASSA-N
logP (XLogP3)4
PSA60.8 Ų
HBD / HBA2 / 5
PubChem CIDCID 150311 ↗
GHS safety

Signal word: Warning

GHS09
GHS09

H410 — Działa bardzo toksycznie na organizmy wodne, powodując długotrwałe skutki

Scientific literature

Related literature

2 articles · 0 open access · Sources: PubMed, OpenAlex, Semantic Scholar

Filtry:Eksport:📄 BibTeX📑 RIS📋 EndNote🔧 CSL-JSON

📈 Publication timeline (2 articles)

2022: 1 articles20222025: 1 articles2025

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Dane z PubMed (NIH NLM), OpenAlex (CC0), Semantic Scholar (AI2). AI Summary wygenerowane przez Semantic Scholar TLDR. Artykuły z ikoną wymagają płatnego dostępu.

Synonyms
Ezetimibe · 163222-33-1 · Zetia · Ezetrol · Ezedoc · Sch 58235 · SCH-58235 · SCH58235 · ezetimiba · EOR26LQQ24 · ezetimibum · MK0653 · NSC-758923 · ezetimib · DTXCID9024223
Data sources
Related molecules
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📜 License & ProvenanceMolGod_License_1
Model
Ezetimibe · 163222-33-1
Licence
CC BY 4.0 International (source rights NIEUSTALONE — not yet granted)
Attribution
MolGod Scientific
Licence & provenance record
Ezetimibe (CAS 163222-33-1) →
MolGod molecule record
Ezetimibe →
Source data
PubChem CID 150311 ↗
SHA-256 (STL)
356c388546a2aee138f1ed02ad3793503766ac23217a283b586e264a97c45055
Wikimedia Commons
not published yet
📄 Download 3D model (1 MB)

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