![3-({3-[(4-Fluorophenyl)methyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene}methyl)-9-methyl-2-[(4-methylcyclohexyl)amino]-4H-pyrido[1,2-a]pyrimidin-4-one structure](/static/products/7026/7026-90-6.webp)
3-({3-[(4-Fluorophenyl)methyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene}methyl)-9-methyl-2-[(4-methylcyclohexyl)amino]-4H-pyrido[1,2-a]pyrimidin-4-one
TL;DR: 3-({3-[(4-Fluorophenyl)methyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene}methyl)-9-methyl-2-[(4-methylcyclohexyl)amino]-4H-pyrido[1,2-a]pyrimidin-4-one (CAS 7026-90-6) is a chemical compound with molecular formula C27H27FN4O2S2 and molecular weight 522.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(4-fluorophenyl)methyl]-5-[[9-methyl-2-[(4-methylcyclohexyl)amino]-4-oxopyrido[1,2-a]pyrimidin-3-yl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: 3-({3-[(4-Fluorophenyl)methyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene}methyl)-9-methyl-2-[(4-methylcyclohexyl)amino]-4H-pyrido[1,2-a]pyrimidin-4-one, 3-[(4-fluorophenyl)methyl]-5-[[9-methyl-2-[(4-methylcyclohexyl)amino]-4-oxopyrido[1,2-a]pyrimidin-3-yl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
| Molecular Formula | C27H27FN4O2S2 |
|---|---|
| Molecular Weight | 522.16 g/mol |
| LogP | 5.53402 |
| Topological Polar Surface Area | 66.71 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 522.15594 |
| Heavy Atoms | 36 |
| Complexity | 1426.1996 |
Chemical Identifiers
| CAS Number | 7026-90-6 |
|---|---|
| SMILES | CC1CCC(CC1)NC2=C(C(=O)N3C=CC=C(C3=N2)C)C=C4C(=O)N(C(=S)S4)CC5=CC=C(C=C5)F |
Product Overview
3-({3-[(4-Fluorophenyl)methyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene}methyl)-9-methyl-2-[(4-methylcyclohexyl)amino]-4H-pyrido[1,2-a]pyrimidin-4-one (CAS 7026-90-6), with molecular formula C27H27FN4O2S2 and molecular weight 522.16 g/mol. IUPAC: 3-[(4-fluorophenyl)methyl]-5-[[9-methyl-2-[(4-methylcyclohexyl)amino]-4-oxopyrido[1,2-a]pyrimidin-3-yl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one.
Chemical Property Profile of 3-({3-[(4-Fluorophenyl)methyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene}methyl)-9-methyl-2-[(4-methylcyclohexyl)amino]-4H-pyrido[1,2-a]pyrimidin-4-one
Property Insights of 3-({3-[(4-Fluorophenyl)methyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene}methyl)-9-methyl-2-[(4-methylcyclohexyl)amino]-4H-pyrido[1,2-a]pyrimidin-4-one
The XLogP value of 5.53402 indicates that 3-({3-[(4-Fluorophenyl)methyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene}methyl)-9-methyl-2-[(4-methylcyclohexyl)amino]-4H-pyrido[1,2-a]pyrimidin-4-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.71 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-({3-[(4-Fluorophenyl)methyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene}methyl)-9-methyl-2-[(4-methylcyclohexyl)amino]-4H-pyrido[1,2-a]pyrimidin-4-one. Following Lipinski's Rule of Five, 3-({3-[(4-Fluorophenyl)methyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene}methyl)-9-methyl-2-[(4-methylcyclohexyl)amino]-4H-pyrido[1,2-a]pyrimidin-4-one has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-({3-[(4-Fluorophenyl)methyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene}methyl)-9-methyl-2-[(4-methylcyclohexyl)amino]-4H-pyrido[1,2-a]pyrimidin-4-one?
The CAS number of 3-({3-[(4-Fluorophenyl)methyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene}methyl)-9-methyl-2-[(4-methylcyclohexyl)amino]-4H-pyrido[1,2-a]pyrimidin-4-one is 7026-90-6.
What is the molecular formula of 3-({3-[(4-Fluorophenyl)methyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene}methyl)-9-methyl-2-[(4-methylcyclohexyl)amino]-4H-pyrido[1,2-a]pyrimidin-4-one?
The molecular formula of 3-({3-[(4-Fluorophenyl)methyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene}methyl)-9-methyl-2-[(4-methylcyclohexyl)amino]-4H-pyrido[1,2-a]pyrimidin-4-one is C27H27FN4O2S2.
What is the molecular weight of 3-({3-[(4-Fluorophenyl)methyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene}methyl)-9-methyl-2-[(4-methylcyclohexyl)amino]-4H-pyrido[1,2-a]pyrimidin-4-one?
The molecular weight of 3-({3-[(4-Fluorophenyl)methyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene}methyl)-9-methyl-2-[(4-methylcyclohexyl)amino]-4H-pyrido[1,2-a]pyrimidin-4-one is 522.16 g/mol.
Where can I buy 3-({3-[(4-Fluorophenyl)methyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene}methyl)-9-methyl-2-[(4-methylcyclohexyl)amino]-4H-pyrido[1,2-a]pyrimidin-4-one?
You can request a quote for 3-({3-[(4-Fluorophenyl)methyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene}methyl)-9-methyl-2-[(4-methylcyclohexyl)amino]-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-[(4-Fluorophenyl)methyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene}methyl)-9-methyl-2-[(4-methylcyclohexyl)amino]-4H-pyrido[1,2-a]pyrimidin-4-one?
Yes, KEHONG BIO provides custom synthesis services for 3-({3-[(4-Fluorophenyl)methyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene}methyl)-9-methyl-2-[(4-methylcyclohexyl)amino]-4H-pyrido[1,2-a]pyrimidin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.