N-(2-(1H-indol-3-yl)ethyl)-2-((E)-4-oxo-5-((E)-3-phenylallylidene)-2-thioxothiazolidin-3-yl)acetamide
TL;DR: N-(2-(1H-indol-3-yl)ethyl)-2-((E)-4-oxo-5-((E)-3-phenylallylidene)-2-thioxothiazolidin-3-yl)acetamide (CAS 902018-14-8) is a chemical compound with molecular formula C24H21N3O2S2 and molecular weight 447.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-(1H-indol-3-yl)ethyl]-2-[(5E)-4-oxo-5-[(E)-3-phenylprop-2-enylidene]-2-sulfanylidene-1,3-thiazolidin-3-yl]acetamide
Also Known As: N-(2-(1H-indol-3-yl)ethyl)-2-((E)-4-oxo-5-((E)-3-phenylallylidene)-2-thioxothiazolidin-3-yl)acetamide, N-[2-(1H-indol-3-yl)ethyl]-2-[(5E)-4-oxo-5-[(E)-3-phenylprop-2-enylidene]-2-sulfanylidene-1,3-thiazolidin-3-yl]acetamide, N-[2-(1H-indol-3-yl)ethyl]-2-{(5E)-4-oxo-5-[(2E)-3-phenylprop-2-en-1-ylidene]-2-thioxo-1,3-thiazolidin-3-yl}acetamide
| Molecular Formula | C24H21N3O2S2 |
|---|---|
| Molecular Weight | 447.11 g/mol |
| LogP | 4.2842 |
| Topological Polar Surface Area | 65.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 447.1075 |
| Heavy Atoms | 31 |
| Complexity | 1181.7673 |
Chemical Identifiers
| CAS Number | 902018-14-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)/C=C/C=C/2\C(=O)N(C(=S)S2)CC(=O)NCCC3=CNC4=CC=CC=C43 |
Product Overview
N-(2-(1H-indol-3-yl)ethyl)-2-((E)-4-oxo-5-((E)-3-phenylallylidene)-2-thioxothiazolidin-3-yl)acetamide (CAS 902018-14-8), with molecular formula C24H21N3O2S2 and molecular weight 447.11 g/mol. IUPAC: N-[2-(1H-indol-3-yl)ethyl]-2-[(5E)-4-oxo-5-[(E)-3-phenylprop-2-enylidene]-2-sulfanylidene-1,3-thiazolidin-3-yl]acetamide.
Chemical Property Profile of N-(2-(1H-indol-3-yl)ethyl)-2-((E)-4-oxo-5-((E)-3-phenylallylidene)-2-thioxothiazolidin-3-yl)acetamide
Property Insights of N-(2-(1H-indol-3-yl)ethyl)-2-((E)-4-oxo-5-((E)-3-phenylallylidene)-2-thioxothiazolidin-3-yl)acetamide
The XLogP value of 4.2842 indicates that N-(2-(1H-indol-3-yl)ethyl)-2-((E)-4-oxo-5-((E)-3-phenylallylidene)-2-thioxothiazolidin-3-yl)acetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.2 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(2-(1H-indol-3-yl)ethyl)-2-((E)-4-oxo-5-((E)-3-phenylallylidene)-2-thioxothiazolidin-3-yl)acetamide. Following Lipinski's Rule of Five, N-(2-(1H-indol-3-yl)ethyl)-2-((E)-4-oxo-5-((E)-3-phenylallylidene)-2-thioxothiazolidin-3-yl)acetamide has 2 hydrogen bond donor(s) and 4 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 N-(2-(1H-indol-3-yl)ethyl)-2-((E)-4-oxo-5-((E)-3-phenylallylidene)-2-thioxothiazolidin-3-yl)acetamide?
The CAS number of N-(2-(1H-indol-3-yl)ethyl)-2-((E)-4-oxo-5-((E)-3-phenylallylidene)-2-thioxothiazolidin-3-yl)acetamide is 902018-14-8.
What is the molecular formula of N-(2-(1H-indol-3-yl)ethyl)-2-((E)-4-oxo-5-((E)-3-phenylallylidene)-2-thioxothiazolidin-3-yl)acetamide?
The molecular formula of N-(2-(1H-indol-3-yl)ethyl)-2-((E)-4-oxo-5-((E)-3-phenylallylidene)-2-thioxothiazolidin-3-yl)acetamide is C24H21N3O2S2.
What is the molecular weight of N-(2-(1H-indol-3-yl)ethyl)-2-((E)-4-oxo-5-((E)-3-phenylallylidene)-2-thioxothiazolidin-3-yl)acetamide?
The molecular weight of N-(2-(1H-indol-3-yl)ethyl)-2-((E)-4-oxo-5-((E)-3-phenylallylidene)-2-thioxothiazolidin-3-yl)acetamide is 447.11 g/mol.
Where can I buy N-(2-(1H-indol-3-yl)ethyl)-2-((E)-4-oxo-5-((E)-3-phenylallylidene)-2-thioxothiazolidin-3-yl)acetamide?
You can request a quote for N-(2-(1H-indol-3-yl)ethyl)-2-((E)-4-oxo-5-((E)-3-phenylallylidene)-2-thioxothiazolidin-3-yl)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2-(1H-indol-3-yl)ethyl)-2-((E)-4-oxo-5-((E)-3-phenylallylidene)-2-thioxothiazolidin-3-yl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for N-(2-(1H-indol-3-yl)ethyl)-2-((E)-4-oxo-5-((E)-3-phenylallylidene)-2-thioxothiazolidin-3-yl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.