![2-methylpropyl 4-[(5E)-5-[3-[4-(2-methylpropoxy)-4-oxobutyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoate structure](/static/products/3030/303028-74-2.webp)
2-methylpropyl 4-[(5E)-5-[3-[4-(2-methylpropoxy)-4-oxobutyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoate
TL;DR: 2-methylpropyl 4-[(5E)-5-[3-[4-(2-methylpropoxy)-4-oxobutyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoate (CAS 303028-74-2) is a chemical compound with molecular formula C22H30N2O6S4 and molecular weight 546.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methylpropyl 4-[(5E)-5-[3-[4-(2-methylpropoxy)-4-oxobutyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoate
Also Known As: 2-methylpropyl 4-[(5E)-5-[3-[4-(2-methylpropoxy)-4-oxobutyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoate, (E)-diisobutyl 4,4'-(4,4'-dioxo-2,2'-dithioxo-2H,2'H-[5,5'-bithiazolylidene]-3,3'(4H,4'H)-diyl)dibutanoate, 2-methylpropyl 4-[(5E)-5-{3-[4-(2-methylpropoxy)-4-oxobutyl]-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene}-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]butanoate
| Molecular Formula | C22H30N2O6S4 |
|---|---|
| Molecular Weight | 546.10 g/mol |
| LogP | 3.8774 |
| Topological Polar Surface Area | 93.22 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 12 |
| Exact Mass | 546.0987 |
| Heavy Atoms | 34 |
| Complexity | 816.62054 |
Chemical Identifiers
| CAS Number | 303028-74-2 |
|---|---|
| SMILES | CC(C)COC(=O)CCCN1C(=O)/C(=C\2/C(=O)N(C(=S)S2)CCCC(=O)OCC(C)C)/SC1=S |
Product Overview
2-methylpropyl 4-[(5E)-5-[3-[4-(2-methylpropoxy)-4-oxobutyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoate (CAS 303028-74-2), with molecular formula C22H30N2O6S4 and molecular weight 546.10 g/mol. IUPAC: 2-methylpropyl 4-[(5E)-5-[3-[4-(2-methylpropoxy)-4-oxobutyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoate.
Chemical Property Profile of 2-methylpropyl 4-[(5E)-5-[3-[4-(2-methylpropoxy)-4-oxobutyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoate
Property Insights of 2-methylpropyl 4-[(5E)-5-[3-[4-(2-methylpropoxy)-4-oxobutyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoate
The XLogP value of 3.8774 indicates that 2-methylpropyl 4-[(5E)-5-[3-[4-(2-methylpropoxy)-4-oxobutyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.22 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-methylpropyl 4-[(5E)-5-[3-[4-(2-methylpropoxy)-4-oxobutyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoate. Following Lipinski's Rule of Five, 2-methylpropyl 4-[(5E)-5-[3-[4-(2-methylpropoxy)-4-oxobutyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoate has 0 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-methylpropyl 4-[(5E)-5-[3-[4-(2-methylpropoxy)-4-oxobutyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoate?
The CAS number of 2-methylpropyl 4-[(5E)-5-[3-[4-(2-methylpropoxy)-4-oxobutyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoate is 303028-74-2.
What is the molecular formula of 2-methylpropyl 4-[(5E)-5-[3-[4-(2-methylpropoxy)-4-oxobutyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoate?
The molecular formula of 2-methylpropyl 4-[(5E)-5-[3-[4-(2-methylpropoxy)-4-oxobutyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoate is C22H30N2O6S4.
What is the molecular weight of 2-methylpropyl 4-[(5E)-5-[3-[4-(2-methylpropoxy)-4-oxobutyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoate?
The molecular weight of 2-methylpropyl 4-[(5E)-5-[3-[4-(2-methylpropoxy)-4-oxobutyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoate is 546.10 g/mol.
Where can I buy 2-methylpropyl 4-[(5E)-5-[3-[4-(2-methylpropoxy)-4-oxobutyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoate?
You can request a quote for 2-methylpropyl 4-[(5E)-5-[3-[4-(2-methylpropoxy)-4-oxobutyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-methylpropyl 4-[(5E)-5-[3-[4-(2-methylpropoxy)-4-oxobutyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoate?
Yes, KEHONG BIO provides custom synthesis services for 2-methylpropyl 4-[(5E)-5-[3-[4-(2-methylpropoxy)-4-oxobutyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.