(Z)-6-(4-ethylpiperazin-1-yl)-5-((3-(furan-2-ylmethyl)-4-oxo-2-thioxothiazolidin-5-ylidene)methyl)-1,4-dimethyl-2-oxo-1,2-dihydropyridine-3-carbonitrile
TL;DR: (Z)-6-(4-ethylpiperazin-1-yl)-5-((3-(furan-2-ylmethyl)-4-oxo-2-thioxothiazolidin-5-ylidene)methyl)-1,4-dimethyl-2-oxo-1,2-dihydropyridine-3-carbonitrile (CAS 620150-27-8) is a chemical compound with molecular formula C23H25N5O3S2 and molecular weight 483.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(4-ethylpiperazin-1-yl)-5-[(Z)-[3-(furan-2-ylmethyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]-1,4-dimethyl-2-oxopyridine-3-carbonitrile
Also Known As: (Z)-6-(4-ethylpiperazin-1-yl)-5-((3-(furan-2-ylmethyl)-4-oxo-2-thioxothiazolidin-5-ylidene)methyl)-1,4-dimethyl-2-oxo-1,2-dihydropyridine-3-carbonitrile, 6-(4-Ethyl-piperazin-1-yl)-5-[3-furan-2-ylmethyl-4-oxo-2-thioxo-thiazolidin-(5Z)-ylidenemethyl]-1,4-dimeth yl-2-oxo-1,2-dihydro-pyridine-3-carbonitrile, 6-(4-ethylpiperazin-1-yl)-5-[(Z)-[3-(furan-2-ylmethyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]-1,4-dimethyl-2-oxopyridine-3-carbonitrile, 6-(4-ethylpiperazin-1-yl)-5-{(Z)-[3-(furan-2-ylmethyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-1,4-dimethyl-2-oxo-1,2-dihydropyridine-3-carbonitrile
| Molecular Formula | C23H25N5O3S2 |
|---|---|
| Molecular Weight | 483.14 g/mol |
| LogP | 2.7017 |
| Topological Polar Surface Area | 85.72 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 483.1399 |
| Heavy Atoms | 33 |
| Complexity | 1218.1971 |
Chemical Identifiers
| CAS Number | 620150-27-8 |
|---|---|
| SMILES | CCN1CCN(CC1)C2=C(C(=C(C(=O)N2C)C#N)C)/C=C\3/C(=O)N(C(=S)S3)CC4=CC=CO4 |
Product Overview
(Z)-6-(4-ethylpiperazin-1-yl)-5-((3-(furan-2-ylmethyl)-4-oxo-2-thioxothiazolidin-5-ylidene)methyl)-1,4-dimethyl-2-oxo-1,2-dihydropyridine-3-carbonitrile (CAS 620150-27-8), with molecular formula C23H25N5O3S2 and molecular weight 483.14 g/mol. IUPAC: 6-(4-ethylpiperazin-1-yl)-5-[(Z)-[3-(furan-2-ylmethyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]-1,4-dimethyl-2-oxopyridine-3-carbonitrile.
Chemical Property Profile of (Z)-6-(4-ethylpiperazin-1-yl)-5-((3-(furan-2-ylmethyl)-4-oxo-2-thioxothiazolidin-5-ylidene)methyl)-1,4-dimethyl-2-oxo-1,2-dihydropyridine-3-carbonitrile
Property Insights of (Z)-6-(4-ethylpiperazin-1-yl)-5-((3-(furan-2-ylmethyl)-4-oxo-2-thioxothiazolidin-5-ylidene)methyl)-1,4-dimethyl-2-oxo-1,2-dihydropyridine-3-carbonitrile
The XLogP value of 2.7017 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (Z)-6-(4-ethylpiperazin-1-yl)-5-((3-(furan-2-ylmethyl)-4-oxo-2-thioxothiazolidin-5-ylidene)methyl)-1,4-dimethyl-2-oxo-1,2-dihydropyridine-3-carbonitrile. The TPSA of 85.72 Ų falls within the moderate polarity range, balancing permeability and solubility for (Z)-6-(4-ethylpiperazin-1-yl)-5-((3-(furan-2-ylmethyl)-4-oxo-2-thioxothiazolidin-5-ylidene)methyl)-1,4-dimethyl-2-oxo-1,2-dihydropyridine-3-carbonitrile. Following Lipinski's Rule of Five, (Z)-6-(4-ethylpiperazin-1-yl)-5-((3-(furan-2-ylmethyl)-4-oxo-2-thioxothiazolidin-5-ylidene)methyl)-1,4-dimethyl-2-oxo-1,2-dihydropyridine-3-carbonitrile has 0 hydrogen bond donor(s) and 8 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 (Z)-6-(4-ethylpiperazin-1-yl)-5-((3-(furan-2-ylmethyl)-4-oxo-2-thioxothiazolidin-5-ylidene)methyl)-1,4-dimethyl-2-oxo-1,2-dihydropyridine-3-carbonitrile?
The CAS number of (Z)-6-(4-ethylpiperazin-1-yl)-5-((3-(furan-2-ylmethyl)-4-oxo-2-thioxothiazolidin-5-ylidene)methyl)-1,4-dimethyl-2-oxo-1,2-dihydropyridine-3-carbonitrile is 620150-27-8.
What is the molecular formula of (Z)-6-(4-ethylpiperazin-1-yl)-5-((3-(furan-2-ylmethyl)-4-oxo-2-thioxothiazolidin-5-ylidene)methyl)-1,4-dimethyl-2-oxo-1,2-dihydropyridine-3-carbonitrile?
The molecular formula of (Z)-6-(4-ethylpiperazin-1-yl)-5-((3-(furan-2-ylmethyl)-4-oxo-2-thioxothiazolidin-5-ylidene)methyl)-1,4-dimethyl-2-oxo-1,2-dihydropyridine-3-carbonitrile is C23H25N5O3S2.
What is the molecular weight of (Z)-6-(4-ethylpiperazin-1-yl)-5-((3-(furan-2-ylmethyl)-4-oxo-2-thioxothiazolidin-5-ylidene)methyl)-1,4-dimethyl-2-oxo-1,2-dihydropyridine-3-carbonitrile?
The molecular weight of (Z)-6-(4-ethylpiperazin-1-yl)-5-((3-(furan-2-ylmethyl)-4-oxo-2-thioxothiazolidin-5-ylidene)methyl)-1,4-dimethyl-2-oxo-1,2-dihydropyridine-3-carbonitrile is 483.14 g/mol.
Where can I buy (Z)-6-(4-ethylpiperazin-1-yl)-5-((3-(furan-2-ylmethyl)-4-oxo-2-thioxothiazolidin-5-ylidene)methyl)-1,4-dimethyl-2-oxo-1,2-dihydropyridine-3-carbonitrile?
You can request a quote for (Z)-6-(4-ethylpiperazin-1-yl)-5-((3-(furan-2-ylmethyl)-4-oxo-2-thioxothiazolidin-5-ylidene)methyl)-1,4-dimethyl-2-oxo-1,2-dihydropyridine-3-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Z)-6-(4-ethylpiperazin-1-yl)-5-((3-(furan-2-ylmethyl)-4-oxo-2-thioxothiazolidin-5-ylidene)methyl)-1,4-dimethyl-2-oxo-1,2-dihydropyridine-3-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for (Z)-6-(4-ethylpiperazin-1-yl)-5-((3-(furan-2-ylmethyl)-4-oxo-2-thioxothiazolidin-5-ylidene)methyl)-1,4-dimethyl-2-oxo-1,2-dihydropyridine-3-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.