4-(Benzenesulfinyl)-2-methoxy-3,7-dimethyloctane-3,5-diol
TL;DR: 4-(Benzenesulfinyl)-2-methoxy-3,7-dimethyloctane-3,5-diol (CAS 7236-68-2) is a chemical compound with molecular formula C17H28O4S and molecular weight 328.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(benzenesulfinyl)-2-methoxy-3,7-dimethyloctane-3,5-diol
Also Known As: 4-(benzenesulfinyl)-2-methoxy-3,7-dimethyloctane-3,5-diol, 4-(benzenesulfinyl)-2-methoxy-3,7-dimethyl-octane-3,5-diol
| Molecular Formula | C17H28O4S |
|---|---|
| Molecular Weight | 328.17 g/mol |
| LogP | 2.3557 |
| Topological Polar Surface Area | 66.76 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 328.17084 |
| Heavy Atoms | 22 |
| Complexity | 472.8071 |
Chemical Identifiers
| CAS Number | 7236-68-2 |
|---|---|
| SMILES | CC(C)CC(C(C(C)(C(C)OC)O)S(=O)C1=CC=CC=C1)O |
Product Overview
4-(Benzenesulfinyl)-2-methoxy-3,7-dimethyloctane-3,5-diol (CAS 7236-68-2), with molecular formula C17H28O4S and molecular weight 328.17 g/mol. IUPAC: 4-(benzenesulfinyl)-2-methoxy-3,7-dimethyloctane-3,5-diol.
Chemical Property Profile of 4-(Benzenesulfinyl)-2-methoxy-3,7-dimethyloctane-3,5-diol
Property Insights of 4-(Benzenesulfinyl)-2-methoxy-3,7-dimethyloctane-3,5-diol
The XLogP value of 2.3557 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(Benzenesulfinyl)-2-methoxy-3,7-dimethyloctane-3,5-diol. The TPSA of 66.76 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(Benzenesulfinyl)-2-methoxy-3,7-dimethyloctane-3,5-diol. Following Lipinski's Rule of Five, 4-(Benzenesulfinyl)-2-methoxy-3,7-dimethyloctane-3,5-diol has 2 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 4-(Benzenesulfinyl)-2-methoxy-3,7-dimethyloctane-3,5-diol?
The CAS number of 4-(Benzenesulfinyl)-2-methoxy-3,7-dimethyloctane-3,5-diol is 7236-68-2.
What is the molecular formula of 4-(Benzenesulfinyl)-2-methoxy-3,7-dimethyloctane-3,5-diol?
The molecular formula of 4-(Benzenesulfinyl)-2-methoxy-3,7-dimethyloctane-3,5-diol is C17H28O4S.
What is the molecular weight of 4-(Benzenesulfinyl)-2-methoxy-3,7-dimethyloctane-3,5-diol?
The molecular weight of 4-(Benzenesulfinyl)-2-methoxy-3,7-dimethyloctane-3,5-diol is 328.17 g/mol.
Where can I buy 4-(Benzenesulfinyl)-2-methoxy-3,7-dimethyloctane-3,5-diol?
You can request a quote for 4-(Benzenesulfinyl)-2-methoxy-3,7-dimethyloctane-3,5-diol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(Benzenesulfinyl)-2-methoxy-3,7-dimethyloctane-3,5-diol?
Yes, KEHONG BIO provides custom synthesis services for 4-(Benzenesulfinyl)-2-methoxy-3,7-dimethyloctane-3,5-diol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.