![4-(5-{(Z)-[(2Z)-3-(2-methylpropyl)-4-oxo-2-(phenylimino)-1,3-thiazolidin-5-ylidene]methyl}furan-2-yl)benzoic acid structure](/static/products/496/496936-71-1.png)
4-(5-{(Z)-[(2Z)-3-(2-methylpropyl)-4-oxo-2-(phenylimino)-1,3-thiazolidin-5-ylidene]methyl}furan-2-yl)benzoic acid
TL;DR: 4-(5-{(Z)-[(2Z)-3-(2-methylpropyl)-4-oxo-2-(phenylimino)-1,3-thiazolidin-5-ylidene]methyl}furan-2-yl)benzoic acid (CAS 496936-71-1) is a chemical compound with molecular formula C25H22N2O4S and molecular weight 446.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[5-[(Z)-[3-(2-methylpropyl)-4-oxo-2-phenylimino-1,3-thiazolidin-5-ylidene]methyl]furan-2-yl]benzoic acid
Also Known As: 4-(5-{(Z)-[(2Z)-3-(2-methylpropyl)-4-oxo-2-(phenylimino)-1,3-thiazolidin-5-ylidene]methyl}furan-2-yl)benzoic acid, 4-(5-((Z)-((Z)-3-isobutyl-4-oxo-2-(phenylimino)thiazolidin-5-ylidene)methyl)furan-2-yl)benzoic acid, 4-[5-[(Z)-[3-(2-methylpropyl)-4-oxo-2-phenylimino-1,3-thiazolidin-5-ylidene]methyl]furan-2-yl]benzoic acid
| Molecular Formula | C25H22N2O4S |
|---|---|
| Molecular Weight | 446.13 g/mol |
| LogP | 5.9048 |
| Topological Polar Surface Area | 83.11 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 446.13004 |
| Heavy Atoms | 32 |
| Complexity | 1194.1946 |
Chemical Identifiers
| CAS Number | 496936-71-1 |
|---|---|
| SMILES | CC(C)CN1C(=O)/C(=C/C2=CC=C(O2)C3=CC=C(C=C3)C(=O)O)/SC1=NC4=CC=CC=C4 |
Product Overview
4-(5-{(Z)-[(2Z)-3-(2-methylpropyl)-4-oxo-2-(phenylimino)-1,3-thiazolidin-5-ylidene]methyl}furan-2-yl)benzoic acid (CAS 496936-71-1), with molecular formula C25H22N2O4S and molecular weight 446.13 g/mol. IUPAC: 4-[5-[(Z)-[3-(2-methylpropyl)-4-oxo-2-phenylimino-1,3-thiazolidin-5-ylidene]methyl]furan-2-yl]benzoic acid.
Chemical Property Profile of 4-(5-{(Z)-[(2Z)-3-(2-methylpropyl)-4-oxo-2-(phenylimino)-1,3-thiazolidin-5-ylidene]methyl}furan-2-yl)benzoic acid
Property Insights of 4-(5-{(Z)-[(2Z)-3-(2-methylpropyl)-4-oxo-2-(phenylimino)-1,3-thiazolidin-5-ylidene]methyl}furan-2-yl)benzoic acid
The XLogP value of 5.9048 indicates that 4-(5-{(Z)-[(2Z)-3-(2-methylpropyl)-4-oxo-2-(phenylimino)-1,3-thiazolidin-5-ylidene]methyl}furan-2-yl)benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.11 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(5-{(Z)-[(2Z)-3-(2-methylpropyl)-4-oxo-2-(phenylimino)-1,3-thiazolidin-5-ylidene]methyl}furan-2-yl)benzoic acid. Following Lipinski's Rule of Five, 4-(5-{(Z)-[(2Z)-3-(2-methylpropyl)-4-oxo-2-(phenylimino)-1,3-thiazolidin-5-ylidene]methyl}furan-2-yl)benzoic acid has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-(5-{(Z)-[(2Z)-3-(2-methylpropyl)-4-oxo-2-(phenylimino)-1,3-thiazolidin-5-ylidene]methyl}furan-2-yl)benzoic acid?
The CAS number of 4-(5-{(Z)-[(2Z)-3-(2-methylpropyl)-4-oxo-2-(phenylimino)-1,3-thiazolidin-5-ylidene]methyl}furan-2-yl)benzoic acid is 496936-71-1.
What is the molecular formula of 4-(5-{(Z)-[(2Z)-3-(2-methylpropyl)-4-oxo-2-(phenylimino)-1,3-thiazolidin-5-ylidene]methyl}furan-2-yl)benzoic acid?
The molecular formula of 4-(5-{(Z)-[(2Z)-3-(2-methylpropyl)-4-oxo-2-(phenylimino)-1,3-thiazolidin-5-ylidene]methyl}furan-2-yl)benzoic acid is C25H22N2O4S.
What is the molecular weight of 4-(5-{(Z)-[(2Z)-3-(2-methylpropyl)-4-oxo-2-(phenylimino)-1,3-thiazolidin-5-ylidene]methyl}furan-2-yl)benzoic acid?
The molecular weight of 4-(5-{(Z)-[(2Z)-3-(2-methylpropyl)-4-oxo-2-(phenylimino)-1,3-thiazolidin-5-ylidene]methyl}furan-2-yl)benzoic acid is 446.13 g/mol.
Where can I buy 4-(5-{(Z)-[(2Z)-3-(2-methylpropyl)-4-oxo-2-(phenylimino)-1,3-thiazolidin-5-ylidene]methyl}furan-2-yl)benzoic acid?
You can request a quote for 4-(5-{(Z)-[(2Z)-3-(2-methylpropyl)-4-oxo-2-(phenylimino)-1,3-thiazolidin-5-ylidene]methyl}furan-2-yl)benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(5-{(Z)-[(2Z)-3-(2-methylpropyl)-4-oxo-2-(phenylimino)-1,3-thiazolidin-5-ylidene]methyl}furan-2-yl)benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-(5-{(Z)-[(2Z)-3-(2-methylpropyl)-4-oxo-2-(phenylimino)-1,3-thiazolidin-5-ylidene]methyl}furan-2-yl)benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.