CTK1H3228
TL;DR: CTK1H3228 (CAS 54444-01-8) is a chemical compound with molecular formula C21H26N4O6 and molecular weight 430.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[5-(1,3-diethyl-4-hydroxy-2,6-dioxopyrimidin-5-yl)penta-2,4-dienylidene]-1,3-diethyl-1,3-diazinane-2,4,6-trione
Also Known As: 5-(5-(1,3-Diethyl-1,2,3,4-tetrahydro-6-hydroxy-2,4-dioxo-5-pyrimidinyl)penta-2,4-dienylidene)-1,3-diethylbarbituric acid, 5-[5-(1,3-diethyl-1,2,3,4-tetrahydro-6-hydroxy-2,4-dioxo-5-pyrimidinyl)penta-2,4-dienylidene]-1,3-diethylbarbituric acid
| Molecular Formula | C21H26N4O6 |
|---|---|
| Molecular Weight | 430.19 g/mol |
| LogP | 1.0818 |
| Topological Polar Surface Area | 121.92 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 430.18524 |
| Heavy Atoms | 31 |
| Complexity | 1078.0923 |
Chemical Identifiers
| CAS Number | 54444-01-8 |
|---|---|
| SMILES | CCN1C(=C(C(=O)N(C1=O)CC)C=CC=CC=C2C(=O)N(C(=O)N(C2=O)CC)CC)O |
Product Overview
CTK1H3228 (CAS 54444-01-8), with molecular formula C21H26N4O6 and molecular weight 430.19 g/mol. IUPAC: 5-[5-(1,3-diethyl-4-hydroxy-2,6-dioxopyrimidin-5-yl)penta-2,4-dienylidene]-1,3-diethyl-1,3-diazinane-2,4,6-trione.
Chemical Property Profile of CTK1H3228
Property Insights of CTK1H3228
The XLogP value of 1.0818 suggests moderate lipophilicity, balancing water solubility and membrane permeability for CTK1H3228. The TPSA of 121.92 Ų falls within the moderate polarity range, balancing permeability and solubility for CTK1H3228. Following Lipinski's Rule of Five, CTK1H3228 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 CTK1H3228?
The CAS number of CTK1H3228 is 54444-01-8.
What is the molecular formula of CTK1H3228?
The molecular formula of CTK1H3228 is C21H26N4O6.
What is the molecular weight of CTK1H3228?
The molecular weight of CTK1H3228 is 430.19 g/mol.
Where can I buy CTK1H3228?
You can request a quote for CTK1H3228 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CTK1H3228?
Yes, KEHONG BIO provides custom synthesis services for CTK1H3228 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.