(Z)-4-(5-((3-isopropyl-2,4-dioxothiazolidin-5-ylidene)methyl)furan-2-yl)benzonitrile
TL;DR: (Z)-4-(5-((3-isopropyl-2,4-dioxothiazolidin-5-ylidene)methyl)furan-2-yl)benzonitrile (CAS 577981-84-1) is a chemical compound with molecular formula C18H14N2O3S and molecular weight 338.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[5-[(Z)-(2,4-dioxo-3-propan-2-yl-1,3-thiazolidin-5-ylidene)methyl]furan-2-yl]benzonitrile
Also Known As: (Z)-4-(5-((3-isopropyl-2,4-dioxothiazolidin-5-ylidene)methyl)furan-2-yl)benzonitrile, 4-(5-{(Z)-[2,4-dioxo-3-(propan-2-yl)-1,3-thiazolidin-5-ylidene]methyl}furan-2-yl)benzonitrile, 4-[5-[(Z)-(2,4-dioxo-3-propan-2-yl-1,3-thiazolidin-5-ylidene)methyl]furan-2-yl]benzonitrile
| Molecular Formula | C18H14N2O3S |
|---|---|
| Molecular Weight | 338.07 g/mol |
| LogP | 4.26298 |
| Topological Polar Surface Area | 74.31 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 338.0725 |
| Heavy Atoms | 24 |
| Complexity | 872.414 |
Chemical Identifiers
| CAS Number | 577981-84-1 |
|---|---|
| SMILES | CC(C)N1C(=O)/C(=C/C2=CC=C(O2)C3=CC=C(C=C3)C#N)/SC1=O |
Product Overview
(Z)-4-(5-((3-isopropyl-2,4-dioxothiazolidin-5-ylidene)methyl)furan-2-yl)benzonitrile (CAS 577981-84-1), with molecular formula C18H14N2O3S and molecular weight 338.07 g/mol. IUPAC: 4-[5-[(Z)-(2,4-dioxo-3-propan-2-yl-1,3-thiazolidin-5-ylidene)methyl]furan-2-yl]benzonitrile.
Chemical Property Profile of (Z)-4-(5-((3-isopropyl-2,4-dioxothiazolidin-5-ylidene)methyl)furan-2-yl)benzonitrile
Property Insights of (Z)-4-(5-((3-isopropyl-2,4-dioxothiazolidin-5-ylidene)methyl)furan-2-yl)benzonitrile
The XLogP value of 4.26298 indicates that (Z)-4-(5-((3-isopropyl-2,4-dioxothiazolidin-5-ylidene)methyl)furan-2-yl)benzonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.31 Ų falls within the moderate polarity range, balancing permeability and solubility for (Z)-4-(5-((3-isopropyl-2,4-dioxothiazolidin-5-ylidene)methyl)furan-2-yl)benzonitrile. Following Lipinski's Rule of Five, (Z)-4-(5-((3-isopropyl-2,4-dioxothiazolidin-5-ylidene)methyl)furan-2-yl)benzonitrile has 0 hydrogen bond donor(s) and 5 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 (Z)-4-(5-((3-isopropyl-2,4-dioxothiazolidin-5-ylidene)methyl)furan-2-yl)benzonitrile?
The CAS number of (Z)-4-(5-((3-isopropyl-2,4-dioxothiazolidin-5-ylidene)methyl)furan-2-yl)benzonitrile is 577981-84-1.
What is the molecular formula of (Z)-4-(5-((3-isopropyl-2,4-dioxothiazolidin-5-ylidene)methyl)furan-2-yl)benzonitrile?
The molecular formula of (Z)-4-(5-((3-isopropyl-2,4-dioxothiazolidin-5-ylidene)methyl)furan-2-yl)benzonitrile is C18H14N2O3S.
What is the molecular weight of (Z)-4-(5-((3-isopropyl-2,4-dioxothiazolidin-5-ylidene)methyl)furan-2-yl)benzonitrile?
The molecular weight of (Z)-4-(5-((3-isopropyl-2,4-dioxothiazolidin-5-ylidene)methyl)furan-2-yl)benzonitrile is 338.07 g/mol.
Where can I buy (Z)-4-(5-((3-isopropyl-2,4-dioxothiazolidin-5-ylidene)methyl)furan-2-yl)benzonitrile?
You can request a quote for (Z)-4-(5-((3-isopropyl-2,4-dioxothiazolidin-5-ylidene)methyl)furan-2-yl)benzonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Z)-4-(5-((3-isopropyl-2,4-dioxothiazolidin-5-ylidene)methyl)furan-2-yl)benzonitrile?
Yes, KEHONG BIO provides custom synthesis services for (Z)-4-(5-((3-isopropyl-2,4-dioxothiazolidin-5-ylidene)methyl)furan-2-yl)benzonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.