![4-{[(5Z)-4-oxo-3-phenyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}phenyl 2,3-dihydro-1,4-benzodioxine-6-sulfonate structure](/static/products/327/327104-61-0.png)
4-{[(5Z)-4-oxo-3-phenyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}phenyl 2,3-dihydro-1,4-benzodioxine-6-sulfonate
TL;DR: 4-{[(5Z)-4-oxo-3-phenyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}phenyl 2,3-dihydro-1,4-benzodioxine-6-sulfonate (CAS 327104-61-0) is a chemical compound with molecular formula C24H17NO6S3 and molecular weight 511.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[(E)-(4-oxo-3-phenyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl] 2,3-dihydro-1,4-benzodioxine-6-sulfonate
Also Known As: 4-{[(5Z)-4-oxo-3-phenyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}phenyl 2,3-dihydro-1,4-benzodioxine-6-sulfonate
| Molecular Formula | C24H17NO6S3 |
|---|---|
| Molecular Weight | 511.02 g/mol |
| LogP | 4.6313 |
| Topological Polar Surface Area | 82.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 511.0218 |
| Heavy Atoms | 34 |
| Complexity | 1402.3806 |
Chemical Identifiers
| CAS Number | 327104-61-0 |
|---|---|
| SMILES | C1COC2=C(O1)C=CC(=C2)S(=O)(=O)OC3=CC=C(C=C3)/C=C/4\C(=O)N(C(=S)S4)C5=CC=CC=C5 |
Product Overview
4-{[(5Z)-4-oxo-3-phenyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}phenyl 2,3-dihydro-1,4-benzodioxine-6-sulfonate (CAS 327104-61-0), with molecular formula C24H17NO6S3 and molecular weight 511.02 g/mol. IUPAC: [4-[(E)-(4-oxo-3-phenyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl] 2,3-dihydro-1,4-benzodioxine-6-sulfonate.
Chemical Property Profile of 4-{[(5Z)-4-oxo-3-phenyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}phenyl 2,3-dihydro-1,4-benzodioxine-6-sulfonate
Property Insights of 4-{[(5Z)-4-oxo-3-phenyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}phenyl 2,3-dihydro-1,4-benzodioxine-6-sulfonate
The XLogP value of 4.6313 indicates that 4-{[(5Z)-4-oxo-3-phenyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}phenyl 2,3-dihydro-1,4-benzodioxine-6-sulfonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 82.14 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-{[(5Z)-4-oxo-3-phenyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}phenyl 2,3-dihydro-1,4-benzodioxine-6-sulfonate. Following Lipinski's Rule of Five, 4-{[(5Z)-4-oxo-3-phenyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}phenyl 2,3-dihydro-1,4-benzodioxine-6-sulfonate has 0 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-{[(5Z)-4-oxo-3-phenyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}phenyl 2,3-dihydro-1,4-benzodioxine-6-sulfonate?
The CAS number of 4-{[(5Z)-4-oxo-3-phenyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}phenyl 2,3-dihydro-1,4-benzodioxine-6-sulfonate is 327104-61-0.
What is the molecular formula of 4-{[(5Z)-4-oxo-3-phenyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}phenyl 2,3-dihydro-1,4-benzodioxine-6-sulfonate?
The molecular formula of 4-{[(5Z)-4-oxo-3-phenyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}phenyl 2,3-dihydro-1,4-benzodioxine-6-sulfonate is C24H17NO6S3.
What is the molecular weight of 4-{[(5Z)-4-oxo-3-phenyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}phenyl 2,3-dihydro-1,4-benzodioxine-6-sulfonate?
The molecular weight of 4-{[(5Z)-4-oxo-3-phenyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}phenyl 2,3-dihydro-1,4-benzodioxine-6-sulfonate is 511.02 g/mol.
Where can I buy 4-{[(5Z)-4-oxo-3-phenyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}phenyl 2,3-dihydro-1,4-benzodioxine-6-sulfonate?
You can request a quote for 4-{[(5Z)-4-oxo-3-phenyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}phenyl 2,3-dihydro-1,4-benzodioxine-6-sulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-{[(5Z)-4-oxo-3-phenyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}phenyl 2,3-dihydro-1,4-benzodioxine-6-sulfonate?
Yes, KEHONG BIO provides custom synthesis services for 4-{[(5Z)-4-oxo-3-phenyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}phenyl 2,3-dihydro-1,4-benzodioxine-6-sulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.