1-S,3-S-bis(4-methylphenyl) propanebis(thioate)
TL;DR: 1-S,3-S-bis(4-methylphenyl) propanebis(thioate) (CAS 16854-73-2) is a chemical compound with molecular formula C17H16O2S2 and molecular weight 316.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-S,3-S-bis(4-methylphenyl) propanebis(thioate)
Also Known As: 1-S,3-S-bis(4-methylphenyl) propanebis(thioate), S~1~,S~3~-Bis(4-methylphenyl) propanebis(thioate)
| Molecular Formula | C17H16O2S2 |
|---|---|
| Molecular Weight | 316.06 g/mol |
| LogP | 5.1 |
| Topological Polar Surface Area | 84.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 316.05917 |
| Heavy Atoms | 21 |
| Complexity | 320.0 |
Chemical Identifiers
| CAS Number | 16854-73-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)SC(=O)CC(=O)SC2=CC=C(C=C2)C |
| InChIKey | NWRBQSYVPBOLOM-UHFFFAOYSA-N |
Product Overview
1-S,3-S-bis(4-methylphenyl) propanebis(thioate) (CAS 16854-73-2), with molecular formula C17H16O2S2 and molecular weight 316.06 g/mol. IUPAC: 1-S,3-S-bis(4-methylphenyl) propanebis(thioate).
Chemical Property Profile of 1-S,3-S-bis(4-methylphenyl) propanebis(thioate)
Property Insights of 1-S,3-S-bis(4-methylphenyl) propanebis(thioate)
The XLogP value of 5.1 indicates that 1-S,3-S-bis(4-methylphenyl) propanebis(thioate) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-S,3-S-bis(4-methylphenyl) propanebis(thioate). Following Lipinski's Rule of Five, 1-S,3-S-bis(4-methylphenyl) propanebis(thioate) 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-S,3-S-bis(4-methylphenyl) propanebis(thioate)?
The CAS number of 1-S,3-S-bis(4-methylphenyl) propanebis(thioate) is 16854-73-2.
What is the molecular formula of 1-S,3-S-bis(4-methylphenyl) propanebis(thioate)?
The molecular formula of 1-S,3-S-bis(4-methylphenyl) propanebis(thioate) is C17H16O2S2.
What is the molecular weight of 1-S,3-S-bis(4-methylphenyl) propanebis(thioate)?
The molecular weight of 1-S,3-S-bis(4-methylphenyl) propanebis(thioate) is 316.06 g/mol.
Where can I buy 1-S,3-S-bis(4-methylphenyl) propanebis(thioate)?
You can request a quote for 1-S,3-S-bis(4-methylphenyl) propanebis(thioate) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-S,3-S-bis(4-methylphenyl) propanebis(thioate)?
Yes, KEHONG BIO provides custom synthesis services for 1-S,3-S-bis(4-methylphenyl) propanebis(thioate) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.