Dimethyl 3,3'-dithiobispropionate
TL;DR: Dimethyl 3,3'-dithiobispropionate (CAS 15441-06-2) is a chemical compound with molecular formula C8H14O4S2 and molecular weight 238.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-[(3-methoxy-3-oxopropyl)disulfanyl]propanoate
Also Known As: Dimethyl 3,3'-dithiodipropionate, Dimethyl dithiodipropionate, Dimethyl 3,3'-disulfanediyldipropanoate, Dimethyl 3,3-Dithiodipropionate, Dimethyl 3,3'-dithiobispropionate
| Molecular Formula | C8H14O4S2 |
|---|---|
| Molecular Weight | 238.03 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 103.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 238.03336 |
| Heavy Atoms | 14 |
| Complexity | 164.0 |
Chemical Identifiers
| CAS Number | 15441-06-2 |
|---|---|
| SMILES | COC(=O)CCSSCCC(=O)OC |
| InChIKey | OSZKBWPMEPEYFU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 12 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Dimethyl 3,3'-dithiobispropionate (CAS 15441-06-2), with molecular formula C8H14O4S2 and molecular weight 238.03 g/mol. IUPAC: methyl 3-[(3-methoxy-3-oxopropyl)disulfanyl]propanoate.
Chemical Property Profile of Dimethyl 3,3'-dithiobispropionate
Property Insights of Dimethyl 3,3'-dithiobispropionate
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dimethyl 3,3'-dithiobispropionate. The TPSA of 103.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Dimethyl 3,3'-dithiobispropionate. Following Lipinski's Rule of Five, Dimethyl 3,3'-dithiobispropionate has 0 hydrogen bond donor(s) and 6 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 Dimethyl 3,3'-dithiobispropionate?
The CAS number of Dimethyl 3,3'-dithiobispropionate is 15441-06-2.
What is the molecular formula of Dimethyl 3,3'-dithiobispropionate?
The molecular formula of Dimethyl 3,3'-dithiobispropionate is C8H14O4S2.
What is the molecular weight of Dimethyl 3,3'-dithiobispropionate?
The molecular weight of Dimethyl 3,3'-dithiobispropionate is 238.03 g/mol.
Where can I buy Dimethyl 3,3'-dithiobispropionate?
You can request a quote for Dimethyl 3,3'-dithiobispropionate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dimethyl 3,3'-dithiobispropionate?
Yes, KEHONG BIO provides custom synthesis services for Dimethyl 3,3'-dithiobispropionate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.