![3-O,5-O-diethyl 4-O-[2-(4-methylpiperidin-1-yl)-2-oxoethyl] 2,6-dimethyl-1,4-dihydropyridine-3,4,5-tricarboxylate structure](/static/products/4522/452299-84-2.webp)
3-O,5-O-diethyl 4-O-[2-(4-methylpiperidin-1-yl)-2-oxoethyl] 2,6-dimethyl-1,4-dihydropyridine-3,4,5-tricarboxylate
TL;DR: 3-O,5-O-diethyl 4-O-[2-(4-methylpiperidin-1-yl)-2-oxoethyl] 2,6-dimethyl-1,4-dihydropyridine-3,4,5-tricarboxylate (CAS 452299-84-2) is a chemical compound with molecular formula C22H32N2O7 and molecular weight 436.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-O,5-O-diethyl 4-O-[2-(4-methylpiperidin-1-yl)-2-oxoethyl] 2,6-dimethyl-1,4-dihydropyridine-3,4,5-tricarboxylate
Also Known As: 3-O,5-O-diethyl 4-O-[2-(4-methylpiperidin-1-yl)-2-oxoethyl] 2,6-dimethyl-1,4-dihydropyridine-3,4,5-tricarboxylate, 3,5-diethyl 4-[2-(4-methylpiperidin-1-yl)-2-oxoethyl] 2,6-dimethyl-1,4-dihydropyridine-3,4,5-tricarboxylate
| Molecular Formula | C22H32N2O7 |
|---|---|
| Molecular Weight | 436.22 g/mol |
| LogP | 1.6817 |
| Topological Polar Surface Area | 111.24 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 436.22095 |
| Heavy Atoms | 31 |
| Complexity | 751.68115 |
Chemical Identifiers
| CAS Number | 452299-84-2 |
|---|---|
| SMILES | CCOC(=O)C1=C(NC(=C(C1C(=O)OCC(=O)N2CCC(CC2)C)C(=O)OCC)C)C |
Product Overview
3-O,5-O-diethyl 4-O-[2-(4-methylpiperidin-1-yl)-2-oxoethyl] 2,6-dimethyl-1,4-dihydropyridine-3,4,5-tricarboxylate (CAS 452299-84-2), with molecular formula C22H32N2O7 and molecular weight 436.22 g/mol. IUPAC: 3-O,5-O-diethyl 4-O-[2-(4-methylpiperidin-1-yl)-2-oxoethyl] 2,6-dimethyl-1,4-dihydropyridine-3,4,5-tricarboxylate.
Chemical Property Profile of 3-O,5-O-diethyl 4-O-[2-(4-methylpiperidin-1-yl)-2-oxoethyl] 2,6-dimethyl-1,4-dihydropyridine-3,4,5-tricarboxylate
Property Insights of 3-O,5-O-diethyl 4-O-[2-(4-methylpiperidin-1-yl)-2-oxoethyl] 2,6-dimethyl-1,4-dihydropyridine-3,4,5-tricarboxylate
The XLogP value of 1.6817 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-O,5-O-diethyl 4-O-[2-(4-methylpiperidin-1-yl)-2-oxoethyl] 2,6-dimethyl-1,4-dihydropyridine-3,4,5-tricarboxylate. The TPSA of 111.24 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-O,5-O-diethyl 4-O-[2-(4-methylpiperidin-1-yl)-2-oxoethyl] 2,6-dimethyl-1,4-dihydropyridine-3,4,5-tricarboxylate. Following Lipinski's Rule of Five, 3-O,5-O-diethyl 4-O-[2-(4-methylpiperidin-1-yl)-2-oxoethyl] 2,6-dimethyl-1,4-dihydropyridine-3,4,5-tricarboxylate has 1 hydrogen bond donor(s) and 8 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 3-O,5-O-diethyl 4-O-[2-(4-methylpiperidin-1-yl)-2-oxoethyl] 2,6-dimethyl-1,4-dihydropyridine-3,4,5-tricarboxylate?
The CAS number of 3-O,5-O-diethyl 4-O-[2-(4-methylpiperidin-1-yl)-2-oxoethyl] 2,6-dimethyl-1,4-dihydropyridine-3,4,5-tricarboxylate is 452299-84-2.
What is the molecular formula of 3-O,5-O-diethyl 4-O-[2-(4-methylpiperidin-1-yl)-2-oxoethyl] 2,6-dimethyl-1,4-dihydropyridine-3,4,5-tricarboxylate?
The molecular formula of 3-O,5-O-diethyl 4-O-[2-(4-methylpiperidin-1-yl)-2-oxoethyl] 2,6-dimethyl-1,4-dihydropyridine-3,4,5-tricarboxylate is C22H32N2O7.
What is the molecular weight of 3-O,5-O-diethyl 4-O-[2-(4-methylpiperidin-1-yl)-2-oxoethyl] 2,6-dimethyl-1,4-dihydropyridine-3,4,5-tricarboxylate?
The molecular weight of 3-O,5-O-diethyl 4-O-[2-(4-methylpiperidin-1-yl)-2-oxoethyl] 2,6-dimethyl-1,4-dihydropyridine-3,4,5-tricarboxylate is 436.22 g/mol.
Where can I buy 3-O,5-O-diethyl 4-O-[2-(4-methylpiperidin-1-yl)-2-oxoethyl] 2,6-dimethyl-1,4-dihydropyridine-3,4,5-tricarboxylate?
You can request a quote for 3-O,5-O-diethyl 4-O-[2-(4-methylpiperidin-1-yl)-2-oxoethyl] 2,6-dimethyl-1,4-dihydropyridine-3,4,5-tricarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-O,5-O-diethyl 4-O-[2-(4-methylpiperidin-1-yl)-2-oxoethyl] 2,6-dimethyl-1,4-dihydropyridine-3,4,5-tricarboxylate?
Yes, KEHONG BIO provides custom synthesis services for 3-O,5-O-diethyl 4-O-[2-(4-methylpiperidin-1-yl)-2-oxoethyl] 2,6-dimethyl-1,4-dihydropyridine-3,4,5-tricarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.