1-(1,1'-Biphenyl)-4-yl-3-((2,3,4,5,6-pentafluorophenyl)thio)-1-propanone
TL;DR: 1-(1,1'-Biphenyl)-4-yl-3-((2,3,4,5,6-pentafluorophenyl)thio)-1-propanone (CAS 477320-08-4) is a chemical compound with molecular formula C21H13F5OS and molecular weight 408.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2,3,4,5,6-pentafluorophenyl)sulfanyl-1-(4-phenylphenyl)propan-1-one
Also Known As: 1-[1,1'-biphenyl]-4-yl-3-[(2,3,4,5,6-pentafluorophenyl)sulfanyl]-1-propanone, 3-(2,3,4,5,6-pentafluorophenyl)sulfanyl-1-(4-phenylphenyl)propan-1-one, 1-([1,1'-Biphenyl]-4-yl)-3-((perfluorophenyl)thio)propan-1-one, 1-([1,1'-Biphenyl]-4-yl)-3-[(pentafluorophenyl)sulfanyl]propan-1-one, 1-(1,1'-Biphenyl)-4-yl-3-((2,3,4,5,6-pentafluorophenyl)thio)-1-propanone
| Molecular Formula | C21H13F5OS |
|---|---|
| Molecular Weight | 408.06 g/mol |
| LogP | 6.4142 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 408.06073 |
| Heavy Atoms | 28 |
| Complexity | 974.5497 |
Chemical Identifiers
| CAS Number | 477320-08-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)CCSC3=C(C(=C(C(=C3F)F)F)F)F |
Product Overview
1-(1,1'-Biphenyl)-4-yl-3-((2,3,4,5,6-pentafluorophenyl)thio)-1-propanone (CAS 477320-08-4), with molecular formula C21H13F5OS and molecular weight 408.06 g/mol. IUPAC: 3-(2,3,4,5,6-pentafluorophenyl)sulfanyl-1-(4-phenylphenyl)propan-1-one.
Chemical Property Profile of 1-(1,1'-Biphenyl)-4-yl-3-((2,3,4,5,6-pentafluorophenyl)thio)-1-propanone
Property Insights of 1-(1,1'-Biphenyl)-4-yl-3-((2,3,4,5,6-pentafluorophenyl)thio)-1-propanone
The XLogP value of 6.4142 indicates that 1-(1,1'-Biphenyl)-4-yl-3-((2,3,4,5,6-pentafluorophenyl)thio)-1-propanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.07 Ų, 1-(1,1'-Biphenyl)-4-yl-3-((2,3,4,5,6-pentafluorophenyl)thio)-1-propanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(1,1'-Biphenyl)-4-yl-3-((2,3,4,5,6-pentafluorophenyl)thio)-1-propanone has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-(1,1'-Biphenyl)-4-yl-3-((2,3,4,5,6-pentafluorophenyl)thio)-1-propanone?
The CAS number of 1-(1,1'-Biphenyl)-4-yl-3-((2,3,4,5,6-pentafluorophenyl)thio)-1-propanone is 477320-08-4.
What is the molecular formula of 1-(1,1'-Biphenyl)-4-yl-3-((2,3,4,5,6-pentafluorophenyl)thio)-1-propanone?
The molecular formula of 1-(1,1'-Biphenyl)-4-yl-3-((2,3,4,5,6-pentafluorophenyl)thio)-1-propanone is C21H13F5OS.
What is the molecular weight of 1-(1,1'-Biphenyl)-4-yl-3-((2,3,4,5,6-pentafluorophenyl)thio)-1-propanone?
The molecular weight of 1-(1,1'-Biphenyl)-4-yl-3-((2,3,4,5,6-pentafluorophenyl)thio)-1-propanone is 408.06 g/mol.
Where can I buy 1-(1,1'-Biphenyl)-4-yl-3-((2,3,4,5,6-pentafluorophenyl)thio)-1-propanone?
You can request a quote for 1-(1,1'-Biphenyl)-4-yl-3-((2,3,4,5,6-pentafluorophenyl)thio)-1-propanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(1,1'-Biphenyl)-4-yl-3-((2,3,4,5,6-pentafluorophenyl)thio)-1-propanone?
Yes, KEHONG BIO provides custom synthesis services for 1-(1,1'-Biphenyl)-4-yl-3-((2,3,4,5,6-pentafluorophenyl)thio)-1-propanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.