BAS 00219886
TL;DR: BAS 00219886 (CAS 111393-32-9) is a chemical compound with molecular formula C34H54O2S and molecular weight 526.38 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,6-ditert-butyl-4-[3-[3-(3,5-ditert-butyl-4-hydroxyphenyl)propylsulfanyl]propyl]phenol
Also Known As: BAS 00219886, J1.089.258I, AB01330281-02, F0266-1081, 4,4'-(thiobis(propane-3,1-diyl))bis(2,6-di-tert-butylphenol)
| Molecular Formula | C34H54O2S |
|---|---|
| Molecular Weight | 526.38 g/mol |
| LogP | 9.5864 |
| Topological Polar Surface Area | 40.46 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 526.38446 |
| Heavy Atoms | 37 |
| Complexity | 897.6682 |
Chemical Identifiers
| CAS Number | 111393-32-9 |
|---|---|
| SMILES | CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCCSCCCC2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C |
Product Overview
BAS 00219886 (CAS 111393-32-9), with molecular formula C34H54O2S and molecular weight 526.38 g/mol. IUPAC: 2,6-ditert-butyl-4-[3-[3-(3,5-ditert-butyl-4-hydroxyphenyl)propylsulfanyl]propyl]phenol.
Chemical Property Profile of BAS 00219886
Property Insights of BAS 00219886
The XLogP value of 9.5864 indicates that BAS 00219886 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.46 Ų, BAS 00219886 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00219886 has 2 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 BAS 00219886?
The CAS number of BAS 00219886 is 111393-32-9.
What is the molecular formula of BAS 00219886?
The molecular formula of BAS 00219886 is C34H54O2S.
What is the molecular weight of BAS 00219886?
The molecular weight of BAS 00219886 is 526.38 g/mol.
Where can I buy BAS 00219886?
You can request a quote for BAS 00219886 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00219886?
Yes, KEHONG BIO provides custom synthesis services for BAS 00219886 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.