(E)-2-(5-(4-butylbenzyl)-4-oxo-3-phenylthiazolidin-2-ylidene)-2-cyanoacetamide
TL;DR: (E)-2-(5-(4-butylbenzyl)-4-oxo-3-phenylthiazolidin-2-ylidene)-2-cyanoacetamide (CAS 799786-09-7) is a chemical compound with molecular formula C23H23N3O2S and molecular weight 405.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2E)-2-[5-[(4-butylphenyl)methyl]-4-oxo-3-phenyl-1,3-thiazolidin-2-ylidene]-2-cyanoacetamide
Also Known As: (E)-2-(5-(4-butylbenzyl)-4-oxo-3-phenylthiazolidin-2-ylidene)-2-cyanoacetamide, (2E)-2-[5-[(4-butylphenyl)methyl]-4-oxo-3-phenyl-1,3-thiazolidin-2-ylidene]-2-cyanoacetamide
| Molecular Formula | C23H23N3O2S |
|---|---|
| Molecular Weight | 405.15 g/mol |
| LogP | 3.94078 |
| Topological Polar Surface Area | 87.19 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 405.1511 |
| Heavy Atoms | 29 |
| Complexity | 961.8675 |
Chemical Identifiers
| CAS Number | 799786-09-7 |
|---|---|
| SMILES | CCCCC1=CC=C(C=C1)CC2C(=O)N(/C(=C(/C#N)\C(=O)N)/S2)C3=CC=CC=C3 |
Product Overview
(E)-2-(5-(4-butylbenzyl)-4-oxo-3-phenylthiazolidin-2-ylidene)-2-cyanoacetamide (CAS 799786-09-7), with molecular formula C23H23N3O2S and molecular weight 405.15 g/mol. IUPAC: (2E)-2-[5-[(4-butylphenyl)methyl]-4-oxo-3-phenyl-1,3-thiazolidin-2-ylidene]-2-cyanoacetamide.
Chemical Property Profile of (E)-2-(5-(4-butylbenzyl)-4-oxo-3-phenylthiazolidin-2-ylidene)-2-cyanoacetamide
Property Insights of (E)-2-(5-(4-butylbenzyl)-4-oxo-3-phenylthiazolidin-2-ylidene)-2-cyanoacetamide
The XLogP value of 3.94078 indicates that (E)-2-(5-(4-butylbenzyl)-4-oxo-3-phenylthiazolidin-2-ylidene)-2-cyanoacetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 87.19 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-2-(5-(4-butylbenzyl)-4-oxo-3-phenylthiazolidin-2-ylidene)-2-cyanoacetamide. Following Lipinski's Rule of Five, (E)-2-(5-(4-butylbenzyl)-4-oxo-3-phenylthiazolidin-2-ylidene)-2-cyanoacetamide has 1 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 (E)-2-(5-(4-butylbenzyl)-4-oxo-3-phenylthiazolidin-2-ylidene)-2-cyanoacetamide?
The CAS number of (E)-2-(5-(4-butylbenzyl)-4-oxo-3-phenylthiazolidin-2-ylidene)-2-cyanoacetamide is 799786-09-7.
What is the molecular formula of (E)-2-(5-(4-butylbenzyl)-4-oxo-3-phenylthiazolidin-2-ylidene)-2-cyanoacetamide?
The molecular formula of (E)-2-(5-(4-butylbenzyl)-4-oxo-3-phenylthiazolidin-2-ylidene)-2-cyanoacetamide is C23H23N3O2S.
What is the molecular weight of (E)-2-(5-(4-butylbenzyl)-4-oxo-3-phenylthiazolidin-2-ylidene)-2-cyanoacetamide?
The molecular weight of (E)-2-(5-(4-butylbenzyl)-4-oxo-3-phenylthiazolidin-2-ylidene)-2-cyanoacetamide is 405.15 g/mol.
Where can I buy (E)-2-(5-(4-butylbenzyl)-4-oxo-3-phenylthiazolidin-2-ylidene)-2-cyanoacetamide?
You can request a quote for (E)-2-(5-(4-butylbenzyl)-4-oxo-3-phenylthiazolidin-2-ylidene)-2-cyanoacetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-2-(5-(4-butylbenzyl)-4-oxo-3-phenylthiazolidin-2-ylidene)-2-cyanoacetamide?
Yes, KEHONG BIO provides custom synthesis services for (E)-2-(5-(4-butylbenzyl)-4-oxo-3-phenylthiazolidin-2-ylidene)-2-cyanoacetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.