![3-[[3-(3-Ethoxypropyl)-4-oxo-2-thioxo-5-thiazolidinylidene]methyl]-2-[(2-methoxyethyl)amino]-7-methyl-4H-pyrido[1,2-a]pyrimidin-4-one structure](/static/products/4972/497228-79-2.webp)
3-[[3-(3-Ethoxypropyl)-4-oxo-2-thioxo-5-thiazolidinylidene]methyl]-2-[(2-methoxyethyl)amino]-7-methyl-4H-pyrido[1,2-a]pyrimidin-4-one
TL;DR: 3-[[3-(3-Ethoxypropyl)-4-oxo-2-thioxo-5-thiazolidinylidene]methyl]-2-[(2-methoxyethyl)amino]-7-methyl-4H-pyrido[1,2-a]pyrimidin-4-one (CAS 497228-79-2) is a chemical compound with molecular formula C21H26N4O4S2 and molecular weight 462.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(3-ethoxypropyl)-5-[[2-(2-methoxyethylamino)-7-methyl-4-oxopyrido[1,2-a]pyrimidin-3-yl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: 3-[[3-(3-Ethoxypropyl)-4-oxo-2-thioxo-5-thiazolidinylidene]methyl]-2-[(2-methoxyethyl)amino]-7-methyl-4H-pyrido[1,2-a]pyrimidin-4-one, 3-(3-ethoxypropyl)-5-[[2-(2-methoxyethylamino)-7-methyl-4-oxopyrido[1,2-a]pyrimidin-3-yl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one, 4H-Pyrido[1,2-a]pyrimidin-4-one, 3-[[3-(3-ethoxypropyl)-4-oxo-2-thioxo-5-thiazolidinylidene]methyl]-2-[(2-methoxyethyl)amino]-7-methyl-
| Molecular Formula | C21H26N4O4S2 |
|---|---|
| Molecular Weight | 462.14 g/mol |
| LogP | 2.68902 |
| Topological Polar Surface Area | 85.17 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 10 |
| Exact Mass | 462.13956 |
| Heavy Atoms | 31 |
| Complexity | 1067.2611 |
Chemical Identifiers
| CAS Number | 497228-79-2 |
|---|---|
| SMILES | CCOCCCN1C(=O)C(=CC2=C(N=C3C=CC(=CN3C2=O)C)NCCOC)SC1=S |
Product Overview
3-[[3-(3-Ethoxypropyl)-4-oxo-2-thioxo-5-thiazolidinylidene]methyl]-2-[(2-methoxyethyl)amino]-7-methyl-4H-pyrido[1,2-a]pyrimidin-4-one (CAS 497228-79-2), with molecular formula C21H26N4O4S2 and molecular weight 462.14 g/mol. IUPAC: 3-(3-ethoxypropyl)-5-[[2-(2-methoxyethylamino)-7-methyl-4-oxopyrido[1,2-a]pyrimidin-3-yl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one.
Chemical Property Profile of 3-[[3-(3-Ethoxypropyl)-4-oxo-2-thioxo-5-thiazolidinylidene]methyl]-2-[(2-methoxyethyl)amino]-7-methyl-4H-pyrido[1,2-a]pyrimidin-4-one
Property Insights of 3-[[3-(3-Ethoxypropyl)-4-oxo-2-thioxo-5-thiazolidinylidene]methyl]-2-[(2-methoxyethyl)amino]-7-methyl-4H-pyrido[1,2-a]pyrimidin-4-one
The XLogP value of 2.68902 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[[3-(3-Ethoxypropyl)-4-oxo-2-thioxo-5-thiazolidinylidene]methyl]-2-[(2-methoxyethyl)amino]-7-methyl-4H-pyrido[1,2-a]pyrimidin-4-one. The TPSA of 85.17 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[[3-(3-Ethoxypropyl)-4-oxo-2-thioxo-5-thiazolidinylidene]methyl]-2-[(2-methoxyethyl)amino]-7-methyl-4H-pyrido[1,2-a]pyrimidin-4-one. Following Lipinski's Rule of Five, 3-[[3-(3-Ethoxypropyl)-4-oxo-2-thioxo-5-thiazolidinylidene]methyl]-2-[(2-methoxyethyl)amino]-7-methyl-4H-pyrido[1,2-a]pyrimidin-4-one has 1 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 3-[[3-(3-Ethoxypropyl)-4-oxo-2-thioxo-5-thiazolidinylidene]methyl]-2-[(2-methoxyethyl)amino]-7-methyl-4H-pyrido[1,2-a]pyrimidin-4-one?
The CAS number of 3-[[3-(3-Ethoxypropyl)-4-oxo-2-thioxo-5-thiazolidinylidene]methyl]-2-[(2-methoxyethyl)amino]-7-methyl-4H-pyrido[1,2-a]pyrimidin-4-one is 497228-79-2.
What is the molecular formula of 3-[[3-(3-Ethoxypropyl)-4-oxo-2-thioxo-5-thiazolidinylidene]methyl]-2-[(2-methoxyethyl)amino]-7-methyl-4H-pyrido[1,2-a]pyrimidin-4-one?
The molecular formula of 3-[[3-(3-Ethoxypropyl)-4-oxo-2-thioxo-5-thiazolidinylidene]methyl]-2-[(2-methoxyethyl)amino]-7-methyl-4H-pyrido[1,2-a]pyrimidin-4-one is C21H26N4O4S2.
What is the molecular weight of 3-[[3-(3-Ethoxypropyl)-4-oxo-2-thioxo-5-thiazolidinylidene]methyl]-2-[(2-methoxyethyl)amino]-7-methyl-4H-pyrido[1,2-a]pyrimidin-4-one?
The molecular weight of 3-[[3-(3-Ethoxypropyl)-4-oxo-2-thioxo-5-thiazolidinylidene]methyl]-2-[(2-methoxyethyl)amino]-7-methyl-4H-pyrido[1,2-a]pyrimidin-4-one is 462.14 g/mol.
Where can I buy 3-[[3-(3-Ethoxypropyl)-4-oxo-2-thioxo-5-thiazolidinylidene]methyl]-2-[(2-methoxyethyl)amino]-7-methyl-4H-pyrido[1,2-a]pyrimidin-4-one?
You can request a quote for 3-[[3-(3-Ethoxypropyl)-4-oxo-2-thioxo-5-thiazolidinylidene]methyl]-2-[(2-methoxyethyl)amino]-7-methyl-4H-pyrido[1,2-a]pyrimidin-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[[3-(3-Ethoxypropyl)-4-oxo-2-thioxo-5-thiazolidinylidene]methyl]-2-[(2-methoxyethyl)amino]-7-methyl-4H-pyrido[1,2-a]pyrimidin-4-one?
Yes, KEHONG BIO provides custom synthesis services for 3-[[3-(3-Ethoxypropyl)-4-oxo-2-thioxo-5-thiazolidinylidene]methyl]-2-[(2-methoxyethyl)amino]-7-methyl-4H-pyrido[1,2-a]pyrimidin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.