![(Z)-3-isopropyl-5-((9-methyl-4-oxo-2-(o-tolyloxy)-4H-pyrido[1,2-a]pyrimidin-3-yl)methylene)-2-thioxothiazolidin-4-one structure](/static/products/847/847246-93-9.png)
(Z)-3-isopropyl-5-((9-methyl-4-oxo-2-(o-tolyloxy)-4H-pyrido[1,2-a]pyrimidin-3-yl)methylene)-2-thioxothiazolidin-4-one
TL;DR: (Z)-3-isopropyl-5-((9-methyl-4-oxo-2-(o-tolyloxy)-4H-pyrido[1,2-a]pyrimidin-3-yl)methylene)-2-thioxothiazolidin-4-one (CAS 847246-93-9) is a chemical compound with molecular formula C23H21N3O3S2 and molecular weight 451.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5Z)-5-[[9-methyl-2-(2-methylphenoxy)-4-oxopyrido[1,2-a]pyrimidin-3-yl]methylidene]-3-propan-2-yl-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: (Z)-3-isopropyl-5-((9-methyl-4-oxo-2-(o-tolyloxy)-4H-pyrido[1,2-a]pyrimidin-3-yl)methylene)-2-thioxothiazolidin-4-one, 3-isopropyl-5-{(Z)-1-[9-methyl-2-(2-methylphenoxy)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]methylidene}-2-thioxo-1,3-thiazolan-4-one, (5Z)-5-[[9-methyl-2-(2-methylphenoxy)-4-oxopyrido[1,2-a]pyrimidin-3-yl]methylidene]-3-propan-2-yl-2-sulfanylidene-1,3-thiazolidin-4-one, (5Z)-5-{[9-METHYL-2-(2-METHYLPHENOXY)-4-OXO-4H-PYRIDO[1,2-A]PYRIMIDIN-3-YL]METHYLIDENE}-3-(PROPAN-2-YL)-2-SULFANYLIDENE-1,3-THIAZOLIDIN-4-ONE, 9-methyl-2-(2-methylphenoxy)-3-{(Z)-[4-oxo-3-(propan-2-yl)-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one
| Molecular Formula | C23H21N3O3S2 |
|---|---|
| Molecular Weight | 451.10 g/mol |
| LogP | 4.71324 |
| Topological Polar Surface Area | 63.91 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 451.10245 |
| Heavy Atoms | 31 |
| Complexity | 1311.1548 |
Chemical Identifiers
| CAS Number | 847246-93-9 |
|---|---|
| SMILES | CC1=CC=CC=C1OC2=C(C(=O)N3C=CC=C(C3=N2)C)/C=C\4/C(=O)N(C(=S)S4)C(C)C |
Product Overview
(Z)-3-isopropyl-5-((9-methyl-4-oxo-2-(o-tolyloxy)-4H-pyrido[1,2-a]pyrimidin-3-yl)methylene)-2-thioxothiazolidin-4-one (CAS 847246-93-9), with molecular formula C23H21N3O3S2 and molecular weight 451.10 g/mol. IUPAC: (5Z)-5-[[9-methyl-2-(2-methylphenoxy)-4-oxopyrido[1,2-a]pyrimidin-3-yl]methylidene]-3-propan-2-yl-2-sulfanylidene-1,3-thiazolidin-4-one.
Chemical Property Profile of (Z)-3-isopropyl-5-((9-methyl-4-oxo-2-(o-tolyloxy)-4H-pyrido[1,2-a]pyrimidin-3-yl)methylene)-2-thioxothiazolidin-4-one
Property Insights of (Z)-3-isopropyl-5-((9-methyl-4-oxo-2-(o-tolyloxy)-4H-pyrido[1,2-a]pyrimidin-3-yl)methylene)-2-thioxothiazolidin-4-one
The XLogP value of 4.71324 indicates that (Z)-3-isopropyl-5-((9-methyl-4-oxo-2-(o-tolyloxy)-4H-pyrido[1,2-a]pyrimidin-3-yl)methylene)-2-thioxothiazolidin-4-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.91 Ų falls within the moderate polarity range, balancing permeability and solubility for (Z)-3-isopropyl-5-((9-methyl-4-oxo-2-(o-tolyloxy)-4H-pyrido[1,2-a]pyrimidin-3-yl)methylene)-2-thioxothiazolidin-4-one. Following Lipinski's Rule of Five, (Z)-3-isopropyl-5-((9-methyl-4-oxo-2-(o-tolyloxy)-4H-pyrido[1,2-a]pyrimidin-3-yl)methylene)-2-thioxothiazolidin-4-one has 0 hydrogen bond donor(s) and 6 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-isopropyl-5-((9-methyl-4-oxo-2-(o-tolyloxy)-4H-pyrido[1,2-a]pyrimidin-3-yl)methylene)-2-thioxothiazolidin-4-one?
The CAS number of (Z)-3-isopropyl-5-((9-methyl-4-oxo-2-(o-tolyloxy)-4H-pyrido[1,2-a]pyrimidin-3-yl)methylene)-2-thioxothiazolidin-4-one is 847246-93-9.
What is the molecular formula of (Z)-3-isopropyl-5-((9-methyl-4-oxo-2-(o-tolyloxy)-4H-pyrido[1,2-a]pyrimidin-3-yl)methylene)-2-thioxothiazolidin-4-one?
The molecular formula of (Z)-3-isopropyl-5-((9-methyl-4-oxo-2-(o-tolyloxy)-4H-pyrido[1,2-a]pyrimidin-3-yl)methylene)-2-thioxothiazolidin-4-one is C23H21N3O3S2.
What is the molecular weight of (Z)-3-isopropyl-5-((9-methyl-4-oxo-2-(o-tolyloxy)-4H-pyrido[1,2-a]pyrimidin-3-yl)methylene)-2-thioxothiazolidin-4-one?
The molecular weight of (Z)-3-isopropyl-5-((9-methyl-4-oxo-2-(o-tolyloxy)-4H-pyrido[1,2-a]pyrimidin-3-yl)methylene)-2-thioxothiazolidin-4-one is 451.10 g/mol.
Where can I buy (Z)-3-isopropyl-5-((9-methyl-4-oxo-2-(o-tolyloxy)-4H-pyrido[1,2-a]pyrimidin-3-yl)methylene)-2-thioxothiazolidin-4-one?
You can request a quote for (Z)-3-isopropyl-5-((9-methyl-4-oxo-2-(o-tolyloxy)-4H-pyrido[1,2-a]pyrimidin-3-yl)methylene)-2-thioxothiazolidin-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Z)-3-isopropyl-5-((9-methyl-4-oxo-2-(o-tolyloxy)-4H-pyrido[1,2-a]pyrimidin-3-yl)methylene)-2-thioxothiazolidin-4-one?
Yes, KEHONG BIO provides custom synthesis services for (Z)-3-isopropyl-5-((9-methyl-4-oxo-2-(o-tolyloxy)-4H-pyrido[1,2-a]pyrimidin-3-yl)methylene)-2-thioxothiazolidin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.