N-(3-(1H-imidazol-1-yl)propyl)-3-((E)-4-oxo-5-((E)-3-phenylallylidene)-2-thioxothiazolidin-3-yl)propanamide
TL;DR: N-(3-(1H-imidazol-1-yl)propyl)-3-((E)-4-oxo-5-((E)-3-phenylallylidene)-2-thioxothiazolidin-3-yl)propanamide (CAS 902303-73-5) is a chemical compound with molecular formula C21H22N4O2S2 and molecular weight 426.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-imidazol-1-ylpropyl)-3-[(5E)-4-oxo-5-[(E)-3-phenylprop-2-enylidene]-2-sulfanylidene-1,3-thiazolidin-3-yl]propanamide
Also Known As: N-(3-(1H-imidazol-1-yl)propyl)-3-((E)-4-oxo-5-((E)-3-phenylallylidene)-2-thioxothiazolidin-3-yl)propanamide, N-(3-imidazol-1-ylpropyl)-3-[(5E)-4-oxo-5-[(E)-3-phenylprop-2-enylidene]-2-sulfanylidene-1,3-thiazolidin-3-yl]propanamide, N-[3-(1H-imidazol-1-yl)propyl]-3-{(5E)-4-oxo-5-[(2E)-3-phenylprop-2-en-1-ylidene]-2-thioxo-1,3-thiazolidin-3-yl}propanamide
| Molecular Formula | C21H22N4O2S2 |
|---|---|
| Molecular Weight | 426.12 g/mol |
| LogP | 3.2371 |
| Topological Polar Surface Area | 67.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 426.1184 |
| Heavy Atoms | 29 |
| Complexity | 908.02704 |
Chemical Identifiers
| CAS Number | 902303-73-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)/C=C/C=C/2\C(=O)N(C(=S)S2)CCC(=O)NCCCN3C=CN=C3 |
Product Overview
N-(3-(1H-imidazol-1-yl)propyl)-3-((E)-4-oxo-5-((E)-3-phenylallylidene)-2-thioxothiazolidin-3-yl)propanamide (CAS 902303-73-5), with molecular formula C21H22N4O2S2 and molecular weight 426.12 g/mol. IUPAC: N-(3-imidazol-1-ylpropyl)-3-[(5E)-4-oxo-5-[(E)-3-phenylprop-2-enylidene]-2-sulfanylidene-1,3-thiazolidin-3-yl]propanamide.
Chemical Property Profile of N-(3-(1H-imidazol-1-yl)propyl)-3-((E)-4-oxo-5-((E)-3-phenylallylidene)-2-thioxothiazolidin-3-yl)propanamide
Property Insights of N-(3-(1H-imidazol-1-yl)propyl)-3-((E)-4-oxo-5-((E)-3-phenylallylidene)-2-thioxothiazolidin-3-yl)propanamide
The XLogP value of 3.2371 indicates that N-(3-(1H-imidazol-1-yl)propyl)-3-((E)-4-oxo-5-((E)-3-phenylallylidene)-2-thioxothiazolidin-3-yl)propanamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.23 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(3-(1H-imidazol-1-yl)propyl)-3-((E)-4-oxo-5-((E)-3-phenylallylidene)-2-thioxothiazolidin-3-yl)propanamide. Following Lipinski's Rule of Five, N-(3-(1H-imidazol-1-yl)propyl)-3-((E)-4-oxo-5-((E)-3-phenylallylidene)-2-thioxothiazolidin-3-yl)propanamide has 1 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 N-(3-(1H-imidazol-1-yl)propyl)-3-((E)-4-oxo-5-((E)-3-phenylallylidene)-2-thioxothiazolidin-3-yl)propanamide?
The CAS number of N-(3-(1H-imidazol-1-yl)propyl)-3-((E)-4-oxo-5-((E)-3-phenylallylidene)-2-thioxothiazolidin-3-yl)propanamide is 902303-73-5.
What is the molecular formula of N-(3-(1H-imidazol-1-yl)propyl)-3-((E)-4-oxo-5-((E)-3-phenylallylidene)-2-thioxothiazolidin-3-yl)propanamide?
The molecular formula of N-(3-(1H-imidazol-1-yl)propyl)-3-((E)-4-oxo-5-((E)-3-phenylallylidene)-2-thioxothiazolidin-3-yl)propanamide is C21H22N4O2S2.
What is the molecular weight of N-(3-(1H-imidazol-1-yl)propyl)-3-((E)-4-oxo-5-((E)-3-phenylallylidene)-2-thioxothiazolidin-3-yl)propanamide?
The molecular weight of N-(3-(1H-imidazol-1-yl)propyl)-3-((E)-4-oxo-5-((E)-3-phenylallylidene)-2-thioxothiazolidin-3-yl)propanamide is 426.12 g/mol.
Where can I buy N-(3-(1H-imidazol-1-yl)propyl)-3-((E)-4-oxo-5-((E)-3-phenylallylidene)-2-thioxothiazolidin-3-yl)propanamide?
You can request a quote for N-(3-(1H-imidazol-1-yl)propyl)-3-((E)-4-oxo-5-((E)-3-phenylallylidene)-2-thioxothiazolidin-3-yl)propanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3-(1H-imidazol-1-yl)propyl)-3-((E)-4-oxo-5-((E)-3-phenylallylidene)-2-thioxothiazolidin-3-yl)propanamide?
Yes, KEHONG BIO provides custom synthesis services for N-(3-(1H-imidazol-1-yl)propyl)-3-((E)-4-oxo-5-((E)-3-phenylallylidene)-2-thioxothiazolidin-3-yl)propanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.