![4-[(Z)-(4-chlorophenyl)methylidene]-1-(4-fluorophenyl)-2-[(3,4,4-trifluoro-3-butenyl)sulfanyl]-1H-imidazol-5-one structure](/static/products/4778/477886-74-1.webp)
4-[(Z)-(4-chlorophenyl)methylidene]-1-(4-fluorophenyl)-2-[(3,4,4-trifluoro-3-butenyl)sulfanyl]-1H-imidazol-5-one
TL;DR: 4-[(Z)-(4-chlorophenyl)methylidene]-1-(4-fluorophenyl)-2-[(3,4,4-trifluoro-3-butenyl)sulfanyl]-1H-imidazol-5-one (CAS 477886-74-1) is a chemical compound with molecular formula C20H13ClF4N2OS and molecular weight 440.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(4-chlorophenyl)methylidene]-3-(4-fluorophenyl)-2-(3,4,4-trifluorobut-3-enylsulfanyl)imidazol-4-one
Also Known As: 4-[(Z)-(4-chlorophenyl)methylidene]-1-(4-fluorophenyl)-2-[(3,4,4-trifluoro-3-butenyl)sulfanyl]-1H-imidazol-5-one, 5-[(4-chlorophenyl)methylidene]-3-(4-fluorophenyl)-2-(3,4,4-trifluorobut-3-enylsulfanyl)imidazol-4-one
| Molecular Formula | C20H13ClF4N2OS |
|---|---|
| Molecular Weight | 440.04 g/mol |
| LogP | 6.4237 |
| Topological Polar Surface Area | 32.67 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 440.03732 |
| Heavy Atoms | 29 |
| Complexity | 1000.1462 |
Chemical Identifiers
| CAS Number | 477886-74-1 |
|---|---|
| SMILES | C1=CC(=CC=C1C=C2C(=O)N(C(=N2)SCCC(=C(F)F)F)C3=CC=C(C=C3)F)Cl |
Product Overview
4-[(Z)-(4-chlorophenyl)methylidene]-1-(4-fluorophenyl)-2-[(3,4,4-trifluoro-3-butenyl)sulfanyl]-1H-imidazol-5-one (CAS 477886-74-1), with molecular formula C20H13ClF4N2OS and molecular weight 440.04 g/mol. IUPAC: 5-[(4-chlorophenyl)methylidene]-3-(4-fluorophenyl)-2-(3,4,4-trifluorobut-3-enylsulfanyl)imidazol-4-one.
Chemical Property Profile of 4-[(Z)-(4-chlorophenyl)methylidene]-1-(4-fluorophenyl)-2-[(3,4,4-trifluoro-3-butenyl)sulfanyl]-1H-imidazol-5-one
Property Insights of 4-[(Z)-(4-chlorophenyl)methylidene]-1-(4-fluorophenyl)-2-[(3,4,4-trifluoro-3-butenyl)sulfanyl]-1H-imidazol-5-one
The XLogP value of 6.4237 indicates that 4-[(Z)-(4-chlorophenyl)methylidene]-1-(4-fluorophenyl)-2-[(3,4,4-trifluoro-3-butenyl)sulfanyl]-1H-imidazol-5-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.67 Ų, 4-[(Z)-(4-chlorophenyl)methylidene]-1-(4-fluorophenyl)-2-[(3,4,4-trifluoro-3-butenyl)sulfanyl]-1H-imidazol-5-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-[(Z)-(4-chlorophenyl)methylidene]-1-(4-fluorophenyl)-2-[(3,4,4-trifluoro-3-butenyl)sulfanyl]-1H-imidazol-5-one has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-[(Z)-(4-chlorophenyl)methylidene]-1-(4-fluorophenyl)-2-[(3,4,4-trifluoro-3-butenyl)sulfanyl]-1H-imidazol-5-one?
The CAS number of 4-[(Z)-(4-chlorophenyl)methylidene]-1-(4-fluorophenyl)-2-[(3,4,4-trifluoro-3-butenyl)sulfanyl]-1H-imidazol-5-one is 477886-74-1.
What is the molecular formula of 4-[(Z)-(4-chlorophenyl)methylidene]-1-(4-fluorophenyl)-2-[(3,4,4-trifluoro-3-butenyl)sulfanyl]-1H-imidazol-5-one?
The molecular formula of 4-[(Z)-(4-chlorophenyl)methylidene]-1-(4-fluorophenyl)-2-[(3,4,4-trifluoro-3-butenyl)sulfanyl]-1H-imidazol-5-one is C20H13ClF4N2OS.
What is the molecular weight of 4-[(Z)-(4-chlorophenyl)methylidene]-1-(4-fluorophenyl)-2-[(3,4,4-trifluoro-3-butenyl)sulfanyl]-1H-imidazol-5-one?
The molecular weight of 4-[(Z)-(4-chlorophenyl)methylidene]-1-(4-fluorophenyl)-2-[(3,4,4-trifluoro-3-butenyl)sulfanyl]-1H-imidazol-5-one is 440.04 g/mol.
Where can I buy 4-[(Z)-(4-chlorophenyl)methylidene]-1-(4-fluorophenyl)-2-[(3,4,4-trifluoro-3-butenyl)sulfanyl]-1H-imidazol-5-one?
You can request a quote for 4-[(Z)-(4-chlorophenyl)methylidene]-1-(4-fluorophenyl)-2-[(3,4,4-trifluoro-3-butenyl)sulfanyl]-1H-imidazol-5-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[(Z)-(4-chlorophenyl)methylidene]-1-(4-fluorophenyl)-2-[(3,4,4-trifluoro-3-butenyl)sulfanyl]-1H-imidazol-5-one?
Yes, KEHONG BIO provides custom synthesis services for 4-[(Z)-(4-chlorophenyl)methylidene]-1-(4-fluorophenyl)-2-[(3,4,4-trifluoro-3-butenyl)sulfanyl]-1H-imidazol-5-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.