![2-[(4-{[(2Z)-3-Cyclohexyl-2-(cyclohexylimino)-4-oxo-1,3-thiazolidin-5-ylidene]methyl}-2-iodophenoxy)methyl]benzonitrile structure](/static/products/5314/5314-91-0.webp)
2-[(4-{[(2Z)-3-Cyclohexyl-2-(cyclohexylimino)-4-oxo-1,3-thiazolidin-5-ylidene]methyl}-2-iodophenoxy)methyl]benzonitrile
TL;DR: 2-[(4-{[(2Z)-3-Cyclohexyl-2-(cyclohexylimino)-4-oxo-1,3-thiazolidin-5-ylidene]methyl}-2-iodophenoxy)methyl]benzonitrile (CAS 5314-91-0) is a chemical compound with molecular formula C30H32IN3O2S and molecular weight 625.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[4-[(3-cyclohexyl-2-cyclohexylimino-4-oxo-1,3-thiazolidin-5-ylidene)methyl]-2-iodophenoxy]methyl]benzonitrile
Also Known As: 2-[(4-{[(2Z)-3-Cyclohexyl-2-(cyclohexylimino)-4-oxo-1,3-thiazolidin-5-ylidene]methyl}-2-iodophenoxy)methyl]benzonitrile, 2-[[4-[(3-cyclohexyl-2-cyclohexylimino-4-oxo-1,3-thiazolidin-5-ylidene)methyl]-2-iodophenoxy]methyl]benzonitrile
| Molecular Formula | C30H32IN3O2S |
|---|---|
| Molecular Weight | 625.13 g/mol |
| LogP | 7.67958 |
| Topological Polar Surface Area | 65.69 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 625.126 |
| Heavy Atoms | 37 |
| Complexity | 1239.6278 |
Chemical Identifiers
| CAS Number | 5314-91-0 |
|---|---|
| SMILES | C1CCC(CC1)N=C2N(C(=O)C(=CC3=CC(=C(C=C3)OCC4=CC=CC=C4C#N)I)S2)C5CCCCC5 |
Product Overview
2-[(4-{[(2Z)-3-Cyclohexyl-2-(cyclohexylimino)-4-oxo-1,3-thiazolidin-5-ylidene]methyl}-2-iodophenoxy)methyl]benzonitrile (CAS 5314-91-0), with molecular formula C30H32IN3O2S and molecular weight 625.13 g/mol. IUPAC: 2-[[4-[(3-cyclohexyl-2-cyclohexylimino-4-oxo-1,3-thiazolidin-5-ylidene)methyl]-2-iodophenoxy]methyl]benzonitrile.
Chemical Property Profile of 2-[(4-{[(2Z)-3-Cyclohexyl-2-(cyclohexylimino)-4-oxo-1,3-thiazolidin-5-ylidene]methyl}-2-iodophenoxy)methyl]benzonitrile
Property Insights of 2-[(4-{[(2Z)-3-Cyclohexyl-2-(cyclohexylimino)-4-oxo-1,3-thiazolidin-5-ylidene]methyl}-2-iodophenoxy)methyl]benzonitrile
The XLogP value of 7.67958 indicates that 2-[(4-{[(2Z)-3-Cyclohexyl-2-(cyclohexylimino)-4-oxo-1,3-thiazolidin-5-ylidene]methyl}-2-iodophenoxy)methyl]benzonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.69 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(4-{[(2Z)-3-Cyclohexyl-2-(cyclohexylimino)-4-oxo-1,3-thiazolidin-5-ylidene]methyl}-2-iodophenoxy)methyl]benzonitrile. Following Lipinski's Rule of Five, 2-[(4-{[(2Z)-3-Cyclohexyl-2-(cyclohexylimino)-4-oxo-1,3-thiazolidin-5-ylidene]methyl}-2-iodophenoxy)methyl]benzonitrile has 0 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 2-[(4-{[(2Z)-3-Cyclohexyl-2-(cyclohexylimino)-4-oxo-1,3-thiazolidin-5-ylidene]methyl}-2-iodophenoxy)methyl]benzonitrile?
The CAS number of 2-[(4-{[(2Z)-3-Cyclohexyl-2-(cyclohexylimino)-4-oxo-1,3-thiazolidin-5-ylidene]methyl}-2-iodophenoxy)methyl]benzonitrile is 5314-91-0.
What is the molecular formula of 2-[(4-{[(2Z)-3-Cyclohexyl-2-(cyclohexylimino)-4-oxo-1,3-thiazolidin-5-ylidene]methyl}-2-iodophenoxy)methyl]benzonitrile?
The molecular formula of 2-[(4-{[(2Z)-3-Cyclohexyl-2-(cyclohexylimino)-4-oxo-1,3-thiazolidin-5-ylidene]methyl}-2-iodophenoxy)methyl]benzonitrile is C30H32IN3O2S.
What is the molecular weight of 2-[(4-{[(2Z)-3-Cyclohexyl-2-(cyclohexylimino)-4-oxo-1,3-thiazolidin-5-ylidene]methyl}-2-iodophenoxy)methyl]benzonitrile?
The molecular weight of 2-[(4-{[(2Z)-3-Cyclohexyl-2-(cyclohexylimino)-4-oxo-1,3-thiazolidin-5-ylidene]methyl}-2-iodophenoxy)methyl]benzonitrile is 625.13 g/mol.
Where can I buy 2-[(4-{[(2Z)-3-Cyclohexyl-2-(cyclohexylimino)-4-oxo-1,3-thiazolidin-5-ylidene]methyl}-2-iodophenoxy)methyl]benzonitrile?
You can request a quote for 2-[(4-{[(2Z)-3-Cyclohexyl-2-(cyclohexylimino)-4-oxo-1,3-thiazolidin-5-ylidene]methyl}-2-iodophenoxy)methyl]benzonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(4-{[(2Z)-3-Cyclohexyl-2-(cyclohexylimino)-4-oxo-1,3-thiazolidin-5-ylidene]methyl}-2-iodophenoxy)methyl]benzonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-[(4-{[(2Z)-3-Cyclohexyl-2-(cyclohexylimino)-4-oxo-1,3-thiazolidin-5-ylidene]methyl}-2-iodophenoxy)methyl]benzonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.