![7-methyl-N-(2-methylphenyl)-2-[3-(4-nitrophenyl)prop-2-enylidene]-3-oxo-5-thiophen-2-yl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide structure](/static/products/7061/7061-51-0.webp)
7-methyl-N-(2-methylphenyl)-2-[3-(4-nitrophenyl)prop-2-enylidene]-3-oxo-5-thiophen-2-yl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide
TL;DR: 7-methyl-N-(2-methylphenyl)-2-[3-(4-nitrophenyl)prop-2-enylidene]-3-oxo-5-thiophen-2-yl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide (CAS 7061-51-0) is a chemical compound with molecular formula C28H22N4O4S2 and molecular weight 542.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-methyl-N-(2-methylphenyl)-2-[3-(4-nitrophenyl)prop-2-enylidene]-3-oxo-5-thiophen-2-yl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide
Also Known As: 7-methyl-N-(2-methylphenyl)-2-[3-(4-nitrophenyl)prop-2-enylidene]-3-oxo-5-thiophen-2-yl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide, 7-Methyl-N-(2-methylphenyl)-2-[3-(4-nitrophenyl)prop-2-en-1-ylidene]-3-oxo-5-(thiophen-2-yl)-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboximidic acid
| Molecular Formula | C28H22N4O4S2 |
|---|---|
| Molecular Weight | 542.11 g/mol |
| LogP | 4.81712 |
| Topological Polar Surface Area | 106.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 542.1083 |
| Heavy Atoms | 38 |
| Complexity | 1779.2262 |
Chemical Identifiers
| CAS Number | 7061-51-0 |
|---|---|
| SMILES | CC1=CC=CC=C1NC(=O)C2=C(N=C3N(C2C4=CC=CS4)C(=O)C(=CC=CC5=CC=C(C=C5)[N+](=O)[O-])S3)C |
Product Overview
7-methyl-N-(2-methylphenyl)-2-[3-(4-nitrophenyl)prop-2-enylidene]-3-oxo-5-thiophen-2-yl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide (CAS 7061-51-0), with molecular formula C28H22N4O4S2 and molecular weight 542.11 g/mol. IUPAC: 7-methyl-N-(2-methylphenyl)-2-[3-(4-nitrophenyl)prop-2-enylidene]-3-oxo-5-thiophen-2-yl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide.
Chemical Property Profile of 7-methyl-N-(2-methylphenyl)-2-[3-(4-nitrophenyl)prop-2-enylidene]-3-oxo-5-thiophen-2-yl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide
Property Insights of 7-methyl-N-(2-methylphenyl)-2-[3-(4-nitrophenyl)prop-2-enylidene]-3-oxo-5-thiophen-2-yl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide
The XLogP value of 4.81712 indicates that 7-methyl-N-(2-methylphenyl)-2-[3-(4-nitrophenyl)prop-2-enylidene]-3-oxo-5-thiophen-2-yl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 106.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 7-methyl-N-(2-methylphenyl)-2-[3-(4-nitrophenyl)prop-2-enylidene]-3-oxo-5-thiophen-2-yl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide. Following Lipinski's Rule of Five, 7-methyl-N-(2-methylphenyl)-2-[3-(4-nitrophenyl)prop-2-enylidene]-3-oxo-5-thiophen-2-yl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 7-methyl-N-(2-methylphenyl)-2-[3-(4-nitrophenyl)prop-2-enylidene]-3-oxo-5-thiophen-2-yl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide?
The CAS number of 7-methyl-N-(2-methylphenyl)-2-[3-(4-nitrophenyl)prop-2-enylidene]-3-oxo-5-thiophen-2-yl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide is 7061-51-0.
What is the molecular formula of 7-methyl-N-(2-methylphenyl)-2-[3-(4-nitrophenyl)prop-2-enylidene]-3-oxo-5-thiophen-2-yl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide?
The molecular formula of 7-methyl-N-(2-methylphenyl)-2-[3-(4-nitrophenyl)prop-2-enylidene]-3-oxo-5-thiophen-2-yl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide is C28H22N4O4S2.
What is the molecular weight of 7-methyl-N-(2-methylphenyl)-2-[3-(4-nitrophenyl)prop-2-enylidene]-3-oxo-5-thiophen-2-yl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide?
The molecular weight of 7-methyl-N-(2-methylphenyl)-2-[3-(4-nitrophenyl)prop-2-enylidene]-3-oxo-5-thiophen-2-yl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide is 542.11 g/mol.
Where can I buy 7-methyl-N-(2-methylphenyl)-2-[3-(4-nitrophenyl)prop-2-enylidene]-3-oxo-5-thiophen-2-yl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide?
You can request a quote for 7-methyl-N-(2-methylphenyl)-2-[3-(4-nitrophenyl)prop-2-enylidene]-3-oxo-5-thiophen-2-yl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-methyl-N-(2-methylphenyl)-2-[3-(4-nitrophenyl)prop-2-enylidene]-3-oxo-5-thiophen-2-yl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 7-methyl-N-(2-methylphenyl)-2-[3-(4-nitrophenyl)prop-2-enylidene]-3-oxo-5-thiophen-2-yl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.