![4-{[(5E)-2-(4-acetylpiperazin-1-yl)-4-oxo-4,5-dihydro-1,3-thiazol-5-ylidene]methyl}phenyl benzenesulfonate structure](/static/products/3753/375352-38-8.webp)
4-{[(5E)-2-(4-acetylpiperazin-1-yl)-4-oxo-4,5-dihydro-1,3-thiazol-5-ylidene]methyl}phenyl benzenesulfonate
TL;DR: 4-{[(5E)-2-(4-acetylpiperazin-1-yl)-4-oxo-4,5-dihydro-1,3-thiazol-5-ylidene]methyl}phenyl benzenesulfonate (CAS 375352-38-8) is a chemical compound with molecular formula C22H21N3O5S2 and molecular weight 471.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[(Z)-[2-(4-acetylpiperazin-1-yl)-4-oxo-1,3-thiazol-5-ylidene]methyl]phenyl] benzenesulfonate
Also Known As: 4-{[(5E)-2-(4-acetylpiperazin-1-yl)-4-oxo-4,5-dihydro-1,3-thiazol-5-ylidene]methyl}phenyl benzenesulfonate, (Z)-4-((2-(4-acetylpiperazin-1-yl)-4-oxothiazol-5(4H)-ylidene)methyl)phenyl benzenesulfonate, [4-[(Z)-[2-(4-acetylpiperazin-1-yl)-4-oxo-1,3-thiazol-5-ylidene]methyl]phenyl] benzenesulfonate
| Molecular Formula | C22H21N3O5S2 |
|---|---|
| Molecular Weight | 471.09 g/mol |
| LogP | 2.5887 |
| Topological Polar Surface Area | 96.35 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 471.09225 |
| Heavy Atoms | 32 |
| Complexity | 1183.8319 |
Chemical Identifiers
| CAS Number | 375352-38-8 |
|---|---|
| SMILES | CC(=O)N1CCN(CC1)C2=NC(=O)/C(=C/C3=CC=C(C=C3)OS(=O)(=O)C4=CC=CC=C4)/S2 |
Product Overview
4-{[(5E)-2-(4-acetylpiperazin-1-yl)-4-oxo-4,5-dihydro-1,3-thiazol-5-ylidene]methyl}phenyl benzenesulfonate (CAS 375352-38-8), with molecular formula C22H21N3O5S2 and molecular weight 471.09 g/mol. IUPAC: [4-[(Z)-[2-(4-acetylpiperazin-1-yl)-4-oxo-1,3-thiazol-5-ylidene]methyl]phenyl] benzenesulfonate.
Chemical Property Profile of 4-{[(5E)-2-(4-acetylpiperazin-1-yl)-4-oxo-4,5-dihydro-1,3-thiazol-5-ylidene]methyl}phenyl benzenesulfonate
Property Insights of 4-{[(5E)-2-(4-acetylpiperazin-1-yl)-4-oxo-4,5-dihydro-1,3-thiazol-5-ylidene]methyl}phenyl benzenesulfonate
The XLogP value of 2.5887 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-{[(5E)-2-(4-acetylpiperazin-1-yl)-4-oxo-4,5-dihydro-1,3-thiazol-5-ylidene]methyl}phenyl benzenesulfonate. The TPSA of 96.35 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-{[(5E)-2-(4-acetylpiperazin-1-yl)-4-oxo-4,5-dihydro-1,3-thiazol-5-ylidene]methyl}phenyl benzenesulfonate. Following Lipinski's Rule of Five, 4-{[(5E)-2-(4-acetylpiperazin-1-yl)-4-oxo-4,5-dihydro-1,3-thiazol-5-ylidene]methyl}phenyl benzenesulfonate has 0 hydrogen bond donor(s) and 7 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 4-{[(5E)-2-(4-acetylpiperazin-1-yl)-4-oxo-4,5-dihydro-1,3-thiazol-5-ylidene]methyl}phenyl benzenesulfonate?
The CAS number of 4-{[(5E)-2-(4-acetylpiperazin-1-yl)-4-oxo-4,5-dihydro-1,3-thiazol-5-ylidene]methyl}phenyl benzenesulfonate is 375352-38-8.
What is the molecular formula of 4-{[(5E)-2-(4-acetylpiperazin-1-yl)-4-oxo-4,5-dihydro-1,3-thiazol-5-ylidene]methyl}phenyl benzenesulfonate?
The molecular formula of 4-{[(5E)-2-(4-acetylpiperazin-1-yl)-4-oxo-4,5-dihydro-1,3-thiazol-5-ylidene]methyl}phenyl benzenesulfonate is C22H21N3O5S2.
What is the molecular weight of 4-{[(5E)-2-(4-acetylpiperazin-1-yl)-4-oxo-4,5-dihydro-1,3-thiazol-5-ylidene]methyl}phenyl benzenesulfonate?
The molecular weight of 4-{[(5E)-2-(4-acetylpiperazin-1-yl)-4-oxo-4,5-dihydro-1,3-thiazol-5-ylidene]methyl}phenyl benzenesulfonate is 471.09 g/mol.
Where can I buy 4-{[(5E)-2-(4-acetylpiperazin-1-yl)-4-oxo-4,5-dihydro-1,3-thiazol-5-ylidene]methyl}phenyl benzenesulfonate?
You can request a quote for 4-{[(5E)-2-(4-acetylpiperazin-1-yl)-4-oxo-4,5-dihydro-1,3-thiazol-5-ylidene]methyl}phenyl benzenesulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-{[(5E)-2-(4-acetylpiperazin-1-yl)-4-oxo-4,5-dihydro-1,3-thiazol-5-ylidene]methyl}phenyl benzenesulfonate?
Yes, KEHONG BIO provides custom synthesis services for 4-{[(5E)-2-(4-acetylpiperazin-1-yl)-4-oxo-4,5-dihydro-1,3-thiazol-5-ylidene]methyl}phenyl benzenesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.