(Z)-N-(2-cyanoethyl)-4-(5-(4-ethylbenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)-N-phenylbutanamide
TL;DR: (Z)-N-(2-cyanoethyl)-4-(5-(4-ethylbenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)-N-phenylbutanamide (CAS 315244-18-9) is a chemical compound with molecular formula C25H25N3O2S2 and molecular weight 463.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-cyanoethyl)-4-[(5Z)-5-[(4-ethylphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-N-phenylbutanamide
Also Known As: (Z)-N-(2-cyanoethyl)-4-(5-(4-ethylbenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)-N-phenylbutanamide, N-(2-cyanoethyl)-4-[(5Z)-5-(4-ethylbenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-N-phenylbutanamide, N-(2-cyanoethyl)-4-[(5Z)-5-[(4-ethylphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-N-phenylbutanamide, N-(2-cyanoethyl)-4-{5-[(4-ethylphenyl)methylene]-4-oxo-2-thioxo(1,3-thiazolidi n-3-yl)}-N-phenylbutanamide
| Molecular Formula | C25H25N3O2S2 |
|---|---|
| Molecular Weight | 463.14 g/mol |
| LogP | 5.17728 |
| Topological Polar Surface Area | 64.41 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 463.13882 |
| Heavy Atoms | 32 |
| Complexity | 1043.1067 |
Chemical Identifiers
| CAS Number | 315244-18-9 |
|---|---|
| SMILES | CCC1=CC=C(C=C1)/C=C\2/C(=O)N(C(=S)S2)CCCC(=O)N(CCC#N)C3=CC=CC=C3 |
Product Overview
(Z)-N-(2-cyanoethyl)-4-(5-(4-ethylbenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)-N-phenylbutanamide (CAS 315244-18-9), with molecular formula C25H25N3O2S2 and molecular weight 463.14 g/mol. IUPAC: N-(2-cyanoethyl)-4-[(5Z)-5-[(4-ethylphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-N-phenylbutanamide.
Chemical Property Profile of (Z)-N-(2-cyanoethyl)-4-(5-(4-ethylbenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)-N-phenylbutanamide
Property Insights of (Z)-N-(2-cyanoethyl)-4-(5-(4-ethylbenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)-N-phenylbutanamide
The XLogP value of 5.17728 indicates that (Z)-N-(2-cyanoethyl)-4-(5-(4-ethylbenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)-N-phenylbutanamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.41 Ų falls within the moderate polarity range, balancing permeability and solubility for (Z)-N-(2-cyanoethyl)-4-(5-(4-ethylbenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)-N-phenylbutanamide. Following Lipinski's Rule of Five, (Z)-N-(2-cyanoethyl)-4-(5-(4-ethylbenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)-N-phenylbutanamide 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 (Z)-N-(2-cyanoethyl)-4-(5-(4-ethylbenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)-N-phenylbutanamide?
The CAS number of (Z)-N-(2-cyanoethyl)-4-(5-(4-ethylbenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)-N-phenylbutanamide is 315244-18-9.
What is the molecular formula of (Z)-N-(2-cyanoethyl)-4-(5-(4-ethylbenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)-N-phenylbutanamide?
The molecular formula of (Z)-N-(2-cyanoethyl)-4-(5-(4-ethylbenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)-N-phenylbutanamide is C25H25N3O2S2.
What is the molecular weight of (Z)-N-(2-cyanoethyl)-4-(5-(4-ethylbenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)-N-phenylbutanamide?
The molecular weight of (Z)-N-(2-cyanoethyl)-4-(5-(4-ethylbenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)-N-phenylbutanamide is 463.14 g/mol.
Where can I buy (Z)-N-(2-cyanoethyl)-4-(5-(4-ethylbenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)-N-phenylbutanamide?
You can request a quote for (Z)-N-(2-cyanoethyl)-4-(5-(4-ethylbenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)-N-phenylbutanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Z)-N-(2-cyanoethyl)-4-(5-(4-ethylbenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)-N-phenylbutanamide?
Yes, KEHONG BIO provides custom synthesis services for (Z)-N-(2-cyanoethyl)-4-(5-(4-ethylbenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)-N-phenylbutanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.