UK 55444
TL;DR: UK 55444 (CAS 97290-20-5) is a chemical compound with molecular formula C23H26Cl2N4O6 and molecular weight 524.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-O-ethyl 5-O-methyl 2-[2-(2-amino-5-oxo-4H-imidazol-3-yl)ethoxymethyl]-4-(2,3-dichlorophenyl)-6-methyl-1,4-dihydropyridine-3,5-dicarboxylate
Also Known As: UK 55444, 3-O-ethyl 5-O-methyl 2-[2-(2-amino-5-oxo-4H-imidazol-3-yl)ethoxymethyl]-4-(2,3-dichlorophenyl)-6-methyl-1,4-dihydropyridine-3,5-dicarboxylate, UK 55444, UK 55444, UK 55444, 2-Amino-1-(2-((4-(2,3-dichlorophenyl)-3-(ethoxycarbonyl)-5-(methoxycarbonyl)-6-methyl-1,4-dihydropyrid-2-yl)methoxy)ethyl)-4(5H)imidazolone hemihydrate, 3-Ethyl 5-methyl 4-(2,3-dichlorophenyl)-2-{[2-(4-hydroxy-2-imino-2,5-dihydro-1H-imidazol-1-yl)ethoxy]methyl}-6-methyl-1,4-dihydropyridine-3,5-dicarboxylate
| Molecular Formula | C23H26Cl2N4O6 |
|---|---|
| Molecular Weight | 524.12 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 133.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 11 |
| Exact Mass | 524.1229 |
| Heavy Atoms | 35 |
| Complexity | 950.0 |
Chemical Identifiers
| CAS Number | 97290-20-5 |
|---|---|
| SMILES | CCOC(=O)C1=C(NC(=C(C1C2=C(C(=CC=C2)Cl)Cl)C(=O)OC)C)COCCN3CC(=O)N=C3N |
| InChIKey | PWEQUMVRHICAHB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
UK 55444 (CAS 97290-20-5), with molecular formula C23H26Cl2N4O6 and molecular weight 524.12 g/mol. IUPAC: 3-O-ethyl 5-O-methyl 2-[2-(2-amino-5-oxo-4H-imidazol-3-yl)ethoxymethyl]-4-(2,3-dichlorophenyl)-6-methyl-1,4-dihydropyridine-3,5-dicarboxylate.
Chemical Property Profile of UK 55444
Property Insights of UK 55444
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for UK 55444. The TPSA of 133.0 Ų falls within the moderate polarity range, balancing permeability and solubility for UK 55444. Following Lipinski's Rule of Five, UK 55444 has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of UK 55444?
The CAS number of UK 55444 is 97290-20-5.
What is the molecular formula of UK 55444?
The molecular formula of UK 55444 is C23H26Cl2N4O6.
What is the molecular weight of UK 55444?
The molecular weight of UK 55444 is 524.12 g/mol.
Where can I buy UK 55444?
You can request a quote for UK 55444 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UK 55444?
Yes, KEHONG BIO provides custom synthesis services for UK 55444 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.