Dimethyl 3,3'-(3-methyl-1,5-dioxopentane-1,5-diyl)bis(2-sulfanylidene-1,3-thiazolidine-4-carboxylate)
TL;DR: Dimethyl 3,3'-(3-methyl-1,5-dioxopentane-1,5-diyl)bis(2-sulfanylidene-1,3-thiazolidine-4-carboxylate) (CAS 7239-05-6) is a chemical compound with molecular formula C16H20N2O6S4 and molecular weight 464.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-[5-(4-methoxycarbonyl-2-sulfanylidene-1,3-thiazolidin-3-yl)-3-methyl-5-oxopentanoyl]-2-sulfanylidene-1,3-thiazolidine-4-carboxylate
Also Known As: Dimethyl 3,3'-(3-methyl-1,5-dioxopentane-1,5-diyl)bis(2-sulfanylidene-1,3-thiazolidine-4-carboxylate), methyl 3-[5-(4-methoxycarbonyl-2-sulfanylidene-1,3-thiazolidin-3-yl)-3-methyl-5-oxopentanoyl]-2-sulfanylidene-1,3-thiazolidine-4-carboxylate
| Molecular Formula | C16H20N2O6S4 |
|---|---|
| Molecular Weight | 464.02 g/mol |
| LogP | 1.2065 |
| Topological Polar Surface Area | 93.22 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 6 |
| Exact Mass | 464.02042 |
| Heavy Atoms | 28 |
| Complexity | 657.24805 |
Chemical Identifiers
| CAS Number | 7239-05-6 |
|---|---|
| SMILES | CC(CC(=O)N1C(CSC1=S)C(=O)OC)CC(=O)N2C(CSC2=S)C(=O)OC |
Product Overview
Dimethyl 3,3'-(3-methyl-1,5-dioxopentane-1,5-diyl)bis(2-sulfanylidene-1,3-thiazolidine-4-carboxylate) (CAS 7239-05-6), with molecular formula C16H20N2O6S4 and molecular weight 464.02 g/mol. IUPAC: methyl 3-[5-(4-methoxycarbonyl-2-sulfanylidene-1,3-thiazolidin-3-yl)-3-methyl-5-oxopentanoyl]-2-sulfanylidene-1,3-thiazolidine-4-carboxylate.
Chemical Property Profile of Dimethyl 3,3'-(3-methyl-1,5-dioxopentane-1,5-diyl)bis(2-sulfanylidene-1,3-thiazolidine-4-carboxylate)
Property Insights of Dimethyl 3,3'-(3-methyl-1,5-dioxopentane-1,5-diyl)bis(2-sulfanylidene-1,3-thiazolidine-4-carboxylate)
The XLogP value of 1.2065 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dimethyl 3,3'-(3-methyl-1,5-dioxopentane-1,5-diyl)bis(2-sulfanylidene-1,3-thiazolidine-4-carboxylate). The TPSA of 93.22 Ų falls within the moderate polarity range, balancing permeability and solubility for Dimethyl 3,3'-(3-methyl-1,5-dioxopentane-1,5-diyl)bis(2-sulfanylidene-1,3-thiazolidine-4-carboxylate). Following Lipinski's Rule of Five, Dimethyl 3,3'-(3-methyl-1,5-dioxopentane-1,5-diyl)bis(2-sulfanylidene-1,3-thiazolidine-4-carboxylate) has 0 hydrogen bond donor(s) and 10 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'-(3-methyl-1,5-dioxopentane-1,5-diyl)bis(2-sulfanylidene-1,3-thiazolidine-4-carboxylate)?
The CAS number of Dimethyl 3,3'-(3-methyl-1,5-dioxopentane-1,5-diyl)bis(2-sulfanylidene-1,3-thiazolidine-4-carboxylate) is 7239-05-6.
What is the molecular formula of Dimethyl 3,3'-(3-methyl-1,5-dioxopentane-1,5-diyl)bis(2-sulfanylidene-1,3-thiazolidine-4-carboxylate)?
The molecular formula of Dimethyl 3,3'-(3-methyl-1,5-dioxopentane-1,5-diyl)bis(2-sulfanylidene-1,3-thiazolidine-4-carboxylate) is C16H20N2O6S4.
What is the molecular weight of Dimethyl 3,3'-(3-methyl-1,5-dioxopentane-1,5-diyl)bis(2-sulfanylidene-1,3-thiazolidine-4-carboxylate)?
The molecular weight of Dimethyl 3,3'-(3-methyl-1,5-dioxopentane-1,5-diyl)bis(2-sulfanylidene-1,3-thiazolidine-4-carboxylate) is 464.02 g/mol.
Where can I buy Dimethyl 3,3'-(3-methyl-1,5-dioxopentane-1,5-diyl)bis(2-sulfanylidene-1,3-thiazolidine-4-carboxylate)?
You can request a quote for Dimethyl 3,3'-(3-methyl-1,5-dioxopentane-1,5-diyl)bis(2-sulfanylidene-1,3-thiazolidine-4-carboxylate) 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'-(3-methyl-1,5-dioxopentane-1,5-diyl)bis(2-sulfanylidene-1,3-thiazolidine-4-carboxylate)?
Yes, KEHONG BIO provides custom synthesis services for Dimethyl 3,3'-(3-methyl-1,5-dioxopentane-1,5-diyl)bis(2-sulfanylidene-1,3-thiazolidine-4-carboxylate) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.