UK 3A
TL;DR: UK 3A (CAS 194931-82-3) is a chemical compound with molecular formula C25H28N2O8 and molecular weight 484.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(3S,6S,7R,8R)-8-benzyl-3-[(3-hydroxypyridine-2-carbonyl)amino]-6-methyl-4,9-dioxo-1,5-dioxonan-7-yl] 2-methylpropanoate
Also Known As: UK 3A, J1.002.194D, (3S,6S,7R,8R)-8-benzyl-3-{[(3-hydroxypyridin-2-yl)carbonyl]amino}-6-methyl-4,9-dioxo-1,5-dioxonan-7-yl 2-methylpropanoate, [(3S,6S,7R,8R)-8-benzyl-3-[(3-hydroxypyridine-2-carbonyl)amino]-6-methyl-4,9-dioxo-1,5-dioxonan-7-yl] 2-methylpropanoate, ((3S,6S,7R,8R)-8-benzyl-3-((3-hydroxypyridine-2-carbonyl)amino)-6-methyl-4,9-dioxo-1,5-dioxonan-7-yl) 2-methylpropanoate
| Molecular Formula | C25H28N2O8 |
|---|---|
| Molecular Weight | 484.18 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 141.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 7 |
| Exact Mass | 484.18457 |
| Heavy Atoms | 35 |
| Complexity | 767.0 |
Chemical Identifiers
| CAS Number | 194931-82-3 |
|---|---|
| SMILES | C[C@H]1[C@@H]([C@H](C(=O)OC[C@@H](C(=O)O1)NC(=O)C2=C(C=CC=N2)O)CC3=CC=CC=C3)OC(=O)C(C)C |
| InChIKey | LATFDMCUVSRKNK-DKXUYOFUSA-N |
Product Overview
UK 3A (CAS 194931-82-3), with molecular formula C25H28N2O8 and molecular weight 484.18 g/mol. IUPAC: [(3S,6S,7R,8R)-8-benzyl-3-[(3-hydroxypyridine-2-carbonyl)amino]-6-methyl-4,9-dioxo-1,5-dioxonan-7-yl] 2-methylpropanoate.
Chemical Property Profile of UK 3A
Property Insights of UK 3A
The XLogP value of 3.6 indicates that UK 3A is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 141.0 Ų indicates high polarity, suggesting UK 3A may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, UK 3A has 2 hydrogen bond donor(s) and 9 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 UK 3A?
The CAS number of UK 3A is 194931-82-3.
What is the molecular formula of UK 3A?
The molecular formula of UK 3A is C25H28N2O8.
What is the molecular weight of UK 3A?
The molecular weight of UK 3A is 484.18 g/mol.
Where can I buy UK 3A?
You can request a quote for UK 3A directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UK 3A?
Yes, KEHONG BIO provides custom synthesis services for UK 3A and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.