RefChem:544707
TL;DR: RefChem:544707 (CAS 70942-28-8) is a chemical compound with molecular formula C28H48O12S3Sn and molecular weight 792.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-O-[2-[bis[2-(6-methoxy-6-oxohexanoyl)oxyethylsulfanyl]-methylstannyl]sulfanylethyl] 1-O-methyl hexanedioate
Also Known As: 7,15-Dioxa-10,12-dithia-11-stannaheneicosanedioic acid, 11-[[2-[(6-methoxy-1,6-dioxohexyl)oxy]ethyl]thio]-11-methyl-6,16-dioxo-, dimethyl ester, 7,15-Dioxa-10,12-dithia-11-stannaheneicosanedioic acid, 11-((2-((6-methoxy-1,6-dioxohexyl)oxy)ethyl)thio)-11-methyl-6,16-dioxo-, 1,21-dimethyl ester, 7,15-Dioxa-10,12-dithia-11-stannaheneicosanedioic acid, 11-((2-((6-methoxy-1,6-dioxohexyl)oxy)ethyl)thio)-11-methyl-6,16-dioxo-, dimethyl ester, 6-O-[2-[bis[2-(6-methoxy-6-oxohexanoyl)oxyethylsulfanyl]-methylstannyl]sulfanylethyl] 1-O-methyl hexanedioate, 7,15-Dioxa-10,12-dithia-11-stannaheneicosanedioic acid, 11-[[2-[(6-methoxy-1,6-dioxohexyl)oxy]ethyl]thio]-11-methyl-6,16-dioxo-, 1,21-dimethyl ester
| Molecular Formula | C28H48O12S3Sn |
|---|---|
| Molecular Weight | 792.13 g/mol |
| LogP | 4.58 |
| Topological Polar Surface Area | 234.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 15 |
| Rotatable Bonds | 33 |
| Exact Mass | 792.133 |
| Heavy Atoms | 44 |
| Complexity | 767.0 |
Chemical Identifiers
| CAS Number | 70942-28-8 |
|---|---|
| SMILES | COC(=O)CCCCC(=O)OCCS[Sn](C)(SCCOC(=O)CCCCC(=O)OC)SCCOC(=O)CCCCC(=O)OC |
| InChIKey | FZGACYJTFRRBMX-UHFFFAOYSA-K |
Product Overview
RefChem:544707 (CAS 70942-28-8), with molecular formula C28H48O12S3Sn and molecular weight 792.13 g/mol. IUPAC: 6-O-[2-[bis[2-(6-methoxy-6-oxohexanoyl)oxyethylsulfanyl]-methylstannyl]sulfanylethyl] 1-O-methyl hexanedioate.
Chemical Property Profile of RefChem:544707
Property Insights of RefChem:544707
The XLogP value of 4.58 indicates that RefChem:544707 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 234.0 Ų indicates high polarity, suggesting RefChem:544707 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:544707 has 0 hydrogen bond donor(s) and 15 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:544707?
The CAS number of RefChem:544707 is 70942-28-8.
What is the molecular formula of RefChem:544707?
The molecular formula of RefChem:544707 is C28H48O12S3Sn.
What is the molecular weight of RefChem:544707?
The molecular weight of RefChem:544707 is 792.13 g/mol.
Where can I buy RefChem:544707?
You can request a quote for RefChem:544707 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:544707?
Yes, KEHONG BIO provides custom synthesis services for RefChem:544707 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.