CTK4G4524
TL;DR: CTK4G4524 (CAS 30132-47-9) is a chemical compound with molecular formula C25H28N4O4 and molecular weight 448.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-butyl-5-[3-(1-butyl-5-cyano-4-methyl-2,6-dioxo-3-pyridinylidene)prop-1-enyl]-6-hydroxy-4-methyl-2-oxopyridine-3-carbonitrile
Also Known As: 1-Butyl-5-(3-(1-butyl-5-cyano-1,6-dihydro-2-hydroxy-4-methyl-6-oxo-3-pyridyl)allylidene)-1,2,5,6-tetrahydro-4-methyl-2,6-dioxonicotinonitrile, 1-butyl-5-[3-(1-butyl-5-cyano-1,6-dihydro-2-hydroxy-4-methyl-6-oxo-3-pyridyl)allylidene]-1,2,5,6-tetrahydro-4-methyl-2,6-dioxonicotinonitrile, 1-Butyl-5-[3-(1-butyl-5-cyano-1,6-dihydro-4-methyl-2,6-dioxo-3(2H)-pyridinylidene)-1-propen-1-yl]-1,2-dihydro-6-hydroxy-4-methyl-2-oxo-3-pyridinecarbonitrile, 1-butyl-5-[3-(1-butyl-5-cyano-4-methyl-2,6-dioxopyridin-3-ylidene)prop-1-enyl]-6-hydroxy-4-methyl-2-oxopyridine-3-carbonitrile, 3-Pyridinecarbonitrile,1-butyl-5-[3-(1-butyl-5-cyano-1,6-dihydro-4-methyl-2,6-dioxo-3(2H)-pyridinylidene)-1-propen-1-yl]-1,2-dihydro-6-hydroxy-4-methyl-2-oxo-
| Molecular Formula | C25H28N4O4 |
|---|---|
| Molecular Weight | 448.21 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 126.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 448.21106 |
| Heavy Atoms | 33 |
| Complexity | 1130.0 |
Chemical Identifiers
| CAS Number | 30132-47-9 |
|---|---|
| SMILES | CCCCN1C(=C(C(=C(C1=O)C#N)C)C=CC=C2C(=C(C(=O)N(C2=O)CCCC)C#N)C)O |
| InChIKey | BTXMQQSMQACNGJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
CTK4G4524 (CAS 30132-47-9), with molecular formula C25H28N4O4 and molecular weight 448.21 g/mol. IUPAC: 1-butyl-5-[3-(1-butyl-5-cyano-4-methyl-2,6-dioxo-3-pyridinylidene)prop-1-enyl]-6-hydroxy-4-methyl-2-oxopyridine-3-carbonitrile.
Chemical Property Profile of CTK4G4524
Property Insights of CTK4G4524
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for CTK4G4524. The TPSA of 126.0 Ų falls within the moderate polarity range, balancing permeability and solubility for CTK4G4524. Following Lipinski's Rule of Five, CTK4G4524 has 1 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 CTK4G4524?
The CAS number of CTK4G4524 is 30132-47-9.
What is the molecular formula of CTK4G4524?
The molecular formula of CTK4G4524 is C25H28N4O4.
What is the molecular weight of CTK4G4524?
The molecular weight of CTK4G4524 is 448.21 g/mol.
Where can I buy CTK4G4524?
You can request a quote for CTK4G4524 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CTK4G4524?
Yes, KEHONG BIO provides custom synthesis services for CTK4G4524 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.