![(2Z)-2-[[5-(3,4-dimethyl-5-nitrophenyl)-2-furyl]methylene]-7-methyl-3-oxo-5-phenyl-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid ethyl ester structure](/static/products/581/5818-99-5.png)
(2Z)-2-[[5-(3,4-dimethyl-5-nitrophenyl)-2-furyl]methylene]-7-methyl-3-oxo-5-phenyl-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid ethyl ester
TL;DR: (2Z)-2-[[5-(3,4-dimethyl-5-nitrophenyl)-2-furyl]methylene]-7-methyl-3-oxo-5-phenyl-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid ethyl ester (CAS 5818-99-5) is a chemical compound with molecular formula C29H25N3O6S and molecular weight 543.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl (2Z)-2-[[5-(3,4-dimethyl-5-nitrophenyl)furan-2-yl]methylidene]-7-methyl-3-oxo-5-phenyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Also Known As: (2Z)-2-[[5-(3,4-dimethyl-5-nitrophenyl)-2-furyl]methylene]-7-methyl-3-oxo-5-phenyl-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid ethyl ester, ethyl (2Z)-2-[[5-(3,4-dimethyl-5-nitrophenyl)furan-2-yl]methylidene]-7-methyl-3-oxo-5-phenyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
| Molecular Formula | C29H25N3O6S |
|---|---|
| Molecular Weight | 543.15 g/mol |
| LogP | 4.58334 |
| Topological Polar Surface Area | 116.94 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 543.1464 |
| Heavy Atoms | 39 |
| Complexity | 1828.41 |
Chemical Identifiers
| CAS Number | 5818-99-5 |
|---|---|
| SMILES | CCOC(=O)C1=C(N=C2N(C1C3=CC=CC=C3)C(=O)/C(=C/C4=CC=C(O4)C5=CC(=C(C(=C5)C)C)[N+](=O)[O-])/S2)C |
Product Overview
(2Z)-2-[[5-(3,4-dimethyl-5-nitrophenyl)-2-furyl]methylene]-7-methyl-3-oxo-5-phenyl-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid ethyl ester (CAS 5818-99-5), with molecular formula C29H25N3O6S and molecular weight 543.15 g/mol. IUPAC: ethyl (2Z)-2-[[5-(3,4-dimethyl-5-nitrophenyl)furan-2-yl]methylidene]-7-methyl-3-oxo-5-phenyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate.
Chemical Property Profile of (2Z)-2-[[5-(3,4-dimethyl-5-nitrophenyl)-2-furyl]methylene]-7-methyl-3-oxo-5-phenyl-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid ethyl ester
Property Insights of (2Z)-2-[[5-(3,4-dimethyl-5-nitrophenyl)-2-furyl]methylene]-7-methyl-3-oxo-5-phenyl-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid ethyl ester
The XLogP value of 4.58334 indicates that (2Z)-2-[[5-(3,4-dimethyl-5-nitrophenyl)-2-furyl]methylene]-7-methyl-3-oxo-5-phenyl-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid ethyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 116.94 Ų falls within the moderate polarity range, balancing permeability and solubility for (2Z)-2-[[5-(3,4-dimethyl-5-nitrophenyl)-2-furyl]methylene]-7-methyl-3-oxo-5-phenyl-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid ethyl ester. Following Lipinski's Rule of Five, (2Z)-2-[[5-(3,4-dimethyl-5-nitrophenyl)-2-furyl]methylene]-7-methyl-3-oxo-5-phenyl-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid ethyl ester has 0 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (2Z)-2-[[5-(3,4-dimethyl-5-nitrophenyl)-2-furyl]methylene]-7-methyl-3-oxo-5-phenyl-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid ethyl ester?
The CAS number of (2Z)-2-[[5-(3,4-dimethyl-5-nitrophenyl)-2-furyl]methylene]-7-methyl-3-oxo-5-phenyl-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid ethyl ester is 5818-99-5.
What is the molecular formula of (2Z)-2-[[5-(3,4-dimethyl-5-nitrophenyl)-2-furyl]methylene]-7-methyl-3-oxo-5-phenyl-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid ethyl ester?
The molecular formula of (2Z)-2-[[5-(3,4-dimethyl-5-nitrophenyl)-2-furyl]methylene]-7-methyl-3-oxo-5-phenyl-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid ethyl ester is C29H25N3O6S.
What is the molecular weight of (2Z)-2-[[5-(3,4-dimethyl-5-nitrophenyl)-2-furyl]methylene]-7-methyl-3-oxo-5-phenyl-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid ethyl ester?
The molecular weight of (2Z)-2-[[5-(3,4-dimethyl-5-nitrophenyl)-2-furyl]methylene]-7-methyl-3-oxo-5-phenyl-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid ethyl ester is 543.15 g/mol.
Where can I buy (2Z)-2-[[5-(3,4-dimethyl-5-nitrophenyl)-2-furyl]methylene]-7-methyl-3-oxo-5-phenyl-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid ethyl ester?
You can request a quote for (2Z)-2-[[5-(3,4-dimethyl-5-nitrophenyl)-2-furyl]methylene]-7-methyl-3-oxo-5-phenyl-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2Z)-2-[[5-(3,4-dimethyl-5-nitrophenyl)-2-furyl]methylene]-7-methyl-3-oxo-5-phenyl-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for (2Z)-2-[[5-(3,4-dimethyl-5-nitrophenyl)-2-furyl]methylene]-7-methyl-3-oxo-5-phenyl-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.