1,1'-(Hexa-2,4-diyne-1,6-diyldisulfinyl)bis(4-methylbenzene)
TL;DR: 1,1'-(Hexa-2,4-diyne-1,6-diyldisulfinyl)bis(4-methylbenzene) (CAS 88018-60-4) is a chemical compound with molecular formula C20H18O2S2 and molecular weight 354.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methyl-4-[6-(4-methylphenyl)sulfinylhexa-2,4-diynylsulfinyl]benzene
Also Known As: 1,1'-(Hexa-2,4-diyne-1,6-diyldisulfinyl)bis(4-methylbenzene), 1-methyl-4-[6-(4-methylphenyl)sulfinylhexa-2,4-diynylsulfiny, 1-methyl-4-[6-(4-methylphenyl)sulfinylhexa-2,4-diynylsulfinyl]benzene, RefChem:212144
| Molecular Formula | C20H18O2S2 |
|---|---|
| Molecular Weight | 354.07 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 72.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 354.07483 |
| Heavy Atoms | 24 |
| Complexity | 528.0 |
Chemical Identifiers
| CAS Number | 88018-60-4 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)CC#CC#CCS(=O)C2=CC=C(C=C2)C |
| InChIKey | IQHJPRJGRNRQOJ-UHFFFAOYSA-N |
Product Overview
1,1'-(Hexa-2,4-diyne-1,6-diyldisulfinyl)bis(4-methylbenzene) (CAS 88018-60-4), with molecular formula C20H18O2S2 and molecular weight 354.07 g/mol. IUPAC: 1-methyl-4-[6-(4-methylphenyl)sulfinylhexa-2,4-diynylsulfinyl]benzene.
Chemical Property Profile of 1,1'-(Hexa-2,4-diyne-1,6-diyldisulfinyl)bis(4-methylbenzene)
Property Insights of 1,1'-(Hexa-2,4-diyne-1,6-diyldisulfinyl)bis(4-methylbenzene)
The XLogP value of 3.2 indicates that 1,1'-(Hexa-2,4-diyne-1,6-diyldisulfinyl)bis(4-methylbenzene) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,1'-(Hexa-2,4-diyne-1,6-diyldisulfinyl)bis(4-methylbenzene). Following Lipinski's Rule of Five, 1,1'-(Hexa-2,4-diyne-1,6-diyldisulfinyl)bis(4-methylbenzene) has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1,1'-(Hexa-2,4-diyne-1,6-diyldisulfinyl)bis(4-methylbenzene)?
The CAS number of 1,1'-(Hexa-2,4-diyne-1,6-diyldisulfinyl)bis(4-methylbenzene) is 88018-60-4.
What is the molecular formula of 1,1'-(Hexa-2,4-diyne-1,6-diyldisulfinyl)bis(4-methylbenzene)?
The molecular formula of 1,1'-(Hexa-2,4-diyne-1,6-diyldisulfinyl)bis(4-methylbenzene) is C20H18O2S2.
What is the molecular weight of 1,1'-(Hexa-2,4-diyne-1,6-diyldisulfinyl)bis(4-methylbenzene)?
The molecular weight of 1,1'-(Hexa-2,4-diyne-1,6-diyldisulfinyl)bis(4-methylbenzene) is 354.07 g/mol.
Where can I buy 1,1'-(Hexa-2,4-diyne-1,6-diyldisulfinyl)bis(4-methylbenzene)?
You can request a quote for 1,1'-(Hexa-2,4-diyne-1,6-diyldisulfinyl)bis(4-methylbenzene) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,1'-(Hexa-2,4-diyne-1,6-diyldisulfinyl)bis(4-methylbenzene)?
Yes, KEHONG BIO provides custom synthesis services for 1,1'-(Hexa-2,4-diyne-1,6-diyldisulfinyl)bis(4-methylbenzene) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.