(Z)-3-(4-(5-((5-(4-nitrophenyl)furan-2-yl)methylene)-4-oxo-4,5-dihydrothiazol-2-yl)piperazin-1-yl)propanenitrile
TL;DR: (Z)-3-(4-(5-((5-(4-nitrophenyl)furan-2-yl)methylene)-4-oxo-4,5-dihydrothiazol-2-yl)piperazin-1-yl)propanenitrile (CAS 444060-99-5) is a chemical compound with molecular formula C21H19N5O4S and molecular weight 437.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[4-[(5Z)-5-[[5-(4-nitrophenyl)furan-2-yl]methylidene]-4-oxo-1,3-thiazol-2-yl]piperazin-1-yl]propanenitrile
Also Known As: (Z)-3-(4-(5-((5-(4-nitrophenyl)furan-2-yl)methylene)-4-oxo-4,5-dihydrothiazol-2-yl)piperazin-1-yl)propanenitrile, 3-[4-[(5Z)-5-[[5-(4-nitrophenyl)furan-2-yl]methylidene]-4-oxo-1,3-thiazol-2-yl]piperazin-1-yl]propanenitrile, 3-{4-[(5Z)-5-{[5-(4-nitrophenyl)furan-2-yl]methylidene}-4-oxo-4,5-dihydro-1,3-thiazol-2-yl]piperazin-1-yl}propanenitrile
| Molecular Formula | C21H19N5O4S |
|---|---|
| Molecular Weight | 437.12 g/mol |
| LogP | 3.35638 |
| Topological Polar Surface Area | 115.98 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 437.11578 |
| Heavy Atoms | 31 |
| Complexity | 1091.7185 |
Chemical Identifiers
| CAS Number | 444060-99-5 |
|---|---|
| SMILES | C1CN(CCN1CCC#N)C2=NC(=O)/C(=C/C3=CC=C(O3)C4=CC=C(C=C4)[N+](=O)[O-])/S2 |
Product Overview
(Z)-3-(4-(5-((5-(4-nitrophenyl)furan-2-yl)methylene)-4-oxo-4,5-dihydrothiazol-2-yl)piperazin-1-yl)propanenitrile (CAS 444060-99-5), with molecular formula C21H19N5O4S and molecular weight 437.12 g/mol. IUPAC: 3-[4-[(5Z)-5-[[5-(4-nitrophenyl)furan-2-yl]methylidene]-4-oxo-1,3-thiazol-2-yl]piperazin-1-yl]propanenitrile.
Chemical Property Profile of (Z)-3-(4-(5-((5-(4-nitrophenyl)furan-2-yl)methylene)-4-oxo-4,5-dihydrothiazol-2-yl)piperazin-1-yl)propanenitrile
Property Insights of (Z)-3-(4-(5-((5-(4-nitrophenyl)furan-2-yl)methylene)-4-oxo-4,5-dihydrothiazol-2-yl)piperazin-1-yl)propanenitrile
The XLogP value of 3.35638 indicates that (Z)-3-(4-(5-((5-(4-nitrophenyl)furan-2-yl)methylene)-4-oxo-4,5-dihydrothiazol-2-yl)piperazin-1-yl)propanenitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 115.98 Ų falls within the moderate polarity range, balancing permeability and solubility for (Z)-3-(4-(5-((5-(4-nitrophenyl)furan-2-yl)methylene)-4-oxo-4,5-dihydrothiazol-2-yl)piperazin-1-yl)propanenitrile. Following Lipinski's Rule of Five, (Z)-3-(4-(5-((5-(4-nitrophenyl)furan-2-yl)methylene)-4-oxo-4,5-dihydrothiazol-2-yl)piperazin-1-yl)propanenitrile 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)-3-(4-(5-((5-(4-nitrophenyl)furan-2-yl)methylene)-4-oxo-4,5-dihydrothiazol-2-yl)piperazin-1-yl)propanenitrile?
The CAS number of (Z)-3-(4-(5-((5-(4-nitrophenyl)furan-2-yl)methylene)-4-oxo-4,5-dihydrothiazol-2-yl)piperazin-1-yl)propanenitrile is 444060-99-5.
What is the molecular formula of (Z)-3-(4-(5-((5-(4-nitrophenyl)furan-2-yl)methylene)-4-oxo-4,5-dihydrothiazol-2-yl)piperazin-1-yl)propanenitrile?
The molecular formula of (Z)-3-(4-(5-((5-(4-nitrophenyl)furan-2-yl)methylene)-4-oxo-4,5-dihydrothiazol-2-yl)piperazin-1-yl)propanenitrile is C21H19N5O4S.
What is the molecular weight of (Z)-3-(4-(5-((5-(4-nitrophenyl)furan-2-yl)methylene)-4-oxo-4,5-dihydrothiazol-2-yl)piperazin-1-yl)propanenitrile?
The molecular weight of (Z)-3-(4-(5-((5-(4-nitrophenyl)furan-2-yl)methylene)-4-oxo-4,5-dihydrothiazol-2-yl)piperazin-1-yl)propanenitrile is 437.12 g/mol.
Where can I buy (Z)-3-(4-(5-((5-(4-nitrophenyl)furan-2-yl)methylene)-4-oxo-4,5-dihydrothiazol-2-yl)piperazin-1-yl)propanenitrile?
You can request a quote for (Z)-3-(4-(5-((5-(4-nitrophenyl)furan-2-yl)methylene)-4-oxo-4,5-dihydrothiazol-2-yl)piperazin-1-yl)propanenitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Z)-3-(4-(5-((5-(4-nitrophenyl)furan-2-yl)methylene)-4-oxo-4,5-dihydrothiazol-2-yl)piperazin-1-yl)propanenitrile?
Yes, KEHONG BIO provides custom synthesis services for (Z)-3-(4-(5-((5-(4-nitrophenyl)furan-2-yl)methylene)-4-oxo-4,5-dihydrothiazol-2-yl)piperazin-1-yl)propanenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.