DiPETMP
TL;DR: DiPETMP (CAS 25359-71-1) is a chemical compound with molecular formula C28H46O13S6 and molecular weight 782.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-(3-sulfanylpropanoyloxy)-2-[[3-(3-sulfanylpropanoyloxy)-2,2-bis(3-sulfanylpropanoyloxymethyl)propoxy]methyl]-2-(3-sulfanylpropanoyloxymethyl)propyl] 3-sulfanylpropanoate
Also Known As: DiPETMP, DIPENTAERYTHRITOL HEXAKIS(3-MERCAPTOPROPIONATE), dipentaerythritol hexa(3-mercaptopropionate), Acetyl-Cys(dodecyl) chloromethyl ketone, C-0704
| Molecular Formula | C28H46O13S6 |
|---|---|
| Molecular Weight | 782.13 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 173.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 19 |
| Rotatable Bonds | 34 |
| Exact Mass | 782.1263 |
| Heavy Atoms | 47 |
| Complexity | 785.0 |
Chemical Identifiers
| CAS Number | 25359-71-1 |
|---|---|
| SMILES | C(CS)C(=O)OCC(COCC(COC(=O)CCS)(COC(=O)CCS)COC(=O)CCS)(COC(=O)CCS)COC(=O)CCS |
| InChIKey | YAAUVJUJVBJRSQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
DiPETMP (CAS 25359-71-1), with molecular formula C28H46O13S6 and molecular weight 782.13 g/mol. IUPAC: [3-(3-sulfanylpropanoyloxy)-2-[[3-(3-sulfanylpropanoyloxy)-2,2-bis(3-sulfanylpropanoyloxymethyl)propoxy]methyl]-2-(3-sulfanylpropanoyloxymethyl)propyl] 3-sulfanylpropanoate.
Chemical Property Profile of DiPETMP
Property Insights of DiPETMP
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for DiPETMP. The TPSA of 173.0 Ų indicates high polarity, suggesting DiPETMP may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, DiPETMP has 6 hydrogen bond donor(s) and 19 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of DiPETMP?
The CAS number of DiPETMP is 25359-71-1.
What is the molecular formula of DiPETMP?
The molecular formula of DiPETMP is C28H46O13S6.
What is the molecular weight of DiPETMP?
The molecular weight of DiPETMP is 782.13 g/mol.
Where can I buy DiPETMP?
You can request a quote for DiPETMP directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for DiPETMP?
Yes, KEHONG BIO provides custom synthesis services for DiPETMP and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.