1,1'-(1,4-Phenylene)bis(2-(phenylthio)ethanone)
TL;DR: 1,1'-(1,4-Phenylene)bis(2-(phenylthio)ethanone) (CAS 369606-87-1) is a chemical compound with molecular formula C22H18O2S2 and molecular weight 378.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-phenylsulfanyl-1-[4-(2-phenylsulfanylacetyl)phenyl]ethanone
Also Known As: 1,1'-(1,4-phenylene)bis(2-(phenylthio)ethanone), 1,1'-benzene-1,4-diylbis[2-(phenylsulfanyl)ethanone], 2-phenylsulfanyl-1-[4-(2-phenylsulfanylacetyl)phenyl]ethanone
| Molecular Formula | C22H18O2S2 |
|---|---|
| Molecular Weight | 378.07 g/mol |
| LogP | 5.6366 |
| Topological Polar Surface Area | 34.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 378.07483 |
| Heavy Atoms | 26 |
| Complexity | 785.1637 |
Chemical Identifiers
| CAS Number | 369606-87-1 |
|---|---|
| SMILES | C1=CC=C(C=C1)SCC(=O)C2=CC=C(C=C2)C(=O)CSC3=CC=CC=C3 |
Product Overview
1,1'-(1,4-Phenylene)bis(2-(phenylthio)ethanone) (CAS 369606-87-1), with molecular formula C22H18O2S2 and molecular weight 378.07 g/mol. IUPAC: 2-phenylsulfanyl-1-[4-(2-phenylsulfanylacetyl)phenyl]ethanone.
Chemical Property Profile of 1,1'-(1,4-Phenylene)bis(2-(phenylthio)ethanone)
Property Insights of 1,1'-(1,4-Phenylene)bis(2-(phenylthio)ethanone)
The XLogP value of 5.6366 indicates that 1,1'-(1,4-Phenylene)bis(2-(phenylthio)ethanone) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.14 Ų, 1,1'-(1,4-Phenylene)bis(2-(phenylthio)ethanone) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,1'-(1,4-Phenylene)bis(2-(phenylthio)ethanone) has 0 hydrogen bond donor(s) and 4 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'-(1,4-Phenylene)bis(2-(phenylthio)ethanone)?
The CAS number of 1,1'-(1,4-Phenylene)bis(2-(phenylthio)ethanone) is 369606-87-1.
What is the molecular formula of 1,1'-(1,4-Phenylene)bis(2-(phenylthio)ethanone)?
The molecular formula of 1,1'-(1,4-Phenylene)bis(2-(phenylthio)ethanone) is C22H18O2S2.
What is the molecular weight of 1,1'-(1,4-Phenylene)bis(2-(phenylthio)ethanone)?
The molecular weight of 1,1'-(1,4-Phenylene)bis(2-(phenylthio)ethanone) is 378.07 g/mol.
Where can I buy 1,1'-(1,4-Phenylene)bis(2-(phenylthio)ethanone)?
You can request a quote for 1,1'-(1,4-Phenylene)bis(2-(phenylthio)ethanone) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,1'-(1,4-Phenylene)bis(2-(phenylthio)ethanone)?
Yes, KEHONG BIO provides custom synthesis services for 1,1'-(1,4-Phenylene)bis(2-(phenylthio)ethanone) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.