ETHYL 1-[2-(4-BENZYL-PIPERIDIN-1-YL)-2-OXO-ETHYL]-2-METHYL-6-OXO-4-(4-PHENYLMETHOXYPHENYL)-4,5-DIHYDROPYRIDINE-3-CARBOXYLATE
TL;DR: ETHYL 1-[2-(4-BENZYL-PIPERIDIN-1-YL)-2-OXO-ETHYL]-2-METHYL-6-OXO-4-(4-PHENYLMETHOXYPHENYL)-4,5-DIHYDROPYRIDINE-3-CARBOXYLATE (CAS 858774-80-8) is a chemical compound with molecular formula C36H40N2O5 and molecular weight 580.29 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 1-[2-(4-benzylpiperidin-1-yl)-2-oxoethyl]-6-methyl-2-oxo-4-(4-phenylmethoxyphenyl)-3,4-dihydropyridine-5-carboxylate
Also Known As: ETHYL 1-[2-(4-BENZYL-PIPERIDIN-1-YL)-2-OXO-ETHYL]-2-METHYL-6-OXO-4-(4-PHENYLMETHOXYPHENYL)-4,5-DIHYDROPYRIDINE-3-CARBOXYLATE, ethyl 1-[2-(4-benzylpiperidin-1-yl)-2-oxoethyl]-6-methyl-2-oxo-4-(4-phenylmethoxyphenyl)-3,4-dihydropyridine-5-carboxylate, Ethyl 4-[4-(benzyloxy)phenyl]-1-[2-(4-benzyl-1-piperidinyl)-2-oxoethyl]-2-methyl-6-oxo-1,4,5,6-tetrahydro-3-pyridinecarboxylate, Ethyl 4-[4-(benzyloxy)phenyl]-1-[2-(4-benzylpiperidin-1-yl)-2-oxoethyl]-2-methyl-6-oxo-1,4,5,6-tetrahydropyridine-3-carboxylate
| Molecular Formula | C36H40N2O5 |
|---|---|
| Molecular Weight | 580.29 g/mol |
| LogP | 5.8999 |
| Topological Polar Surface Area | 76.15 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 10 |
| Exact Mass | 580.2937 |
| Heavy Atoms | 43 |
| Complexity | 1427.4822 |
Chemical Identifiers
| CAS Number | 858774-80-8 |
|---|---|
| SMILES | CCOC(=O)C1=C(N(C(=O)CC1C2=CC=C(C=C2)OCC3=CC=CC=C3)CC(=O)N4CCC(CC4)CC5=CC=CC=C5)C |
Product Overview
ETHYL 1-[2-(4-BENZYL-PIPERIDIN-1-YL)-2-OXO-ETHYL]-2-METHYL-6-OXO-4-(4-PHENYLMETHOXYPHENYL)-4,5-DIHYDROPYRIDINE-3-CARBOXYLATE (CAS 858774-80-8), with molecular formula C36H40N2O5 and molecular weight 580.29 g/mol. IUPAC: ethyl 1-[2-(4-benzylpiperidin-1-yl)-2-oxoethyl]-6-methyl-2-oxo-4-(4-phenylmethoxyphenyl)-3,4-dihydropyridine-5-carboxylate.
Chemical Property Profile of ETHYL 1-[2-(4-BENZYL-PIPERIDIN-1-YL)-2-OXO-ETHYL]-2-METHYL-6-OXO-4-(4-PHENYLMETHOXYPHENYL)-4,5-DIHYDROPYRIDINE-3-CARBOXYLATE
Property Insights of ETHYL 1-[2-(4-BENZYL-PIPERIDIN-1-YL)-2-OXO-ETHYL]-2-METHYL-6-OXO-4-(4-PHENYLMETHOXYPHENYL)-4,5-DIHYDROPYRIDINE-3-CARBOXYLATE
The XLogP value of 5.8999 indicates that ETHYL 1-[2-(4-BENZYL-PIPERIDIN-1-YL)-2-OXO-ETHYL]-2-METHYL-6-OXO-4-(4-PHENYLMETHOXYPHENYL)-4,5-DIHYDROPYRIDINE-3-CARBOXYLATE is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.15 Ų falls within the moderate polarity range, balancing permeability and solubility for ETHYL 1-[2-(4-BENZYL-PIPERIDIN-1-YL)-2-OXO-ETHYL]-2-METHYL-6-OXO-4-(4-PHENYLMETHOXYPHENYL)-4,5-DIHYDROPYRIDINE-3-CARBOXYLATE. Following Lipinski's Rule of Five, ETHYL 1-[2-(4-BENZYL-PIPERIDIN-1-YL)-2-OXO-ETHYL]-2-METHYL-6-OXO-4-(4-PHENYLMETHOXYPHENYL)-4,5-DIHYDROPYRIDINE-3-CARBOXYLATE has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ETHYL 1-[2-(4-BENZYL-PIPERIDIN-1-YL)-2-OXO-ETHYL]-2-METHYL-6-OXO-4-(4-PHENYLMETHOXYPHENYL)-4,5-DIHYDROPYRIDINE-3-CARBOXYLATE?
The CAS number of ETHYL 1-[2-(4-BENZYL-PIPERIDIN-1-YL)-2-OXO-ETHYL]-2-METHYL-6-OXO-4-(4-PHENYLMETHOXYPHENYL)-4,5-DIHYDROPYRIDINE-3-CARBOXYLATE is 858774-80-8.
What is the molecular formula of ETHYL 1-[2-(4-BENZYL-PIPERIDIN-1-YL)-2-OXO-ETHYL]-2-METHYL-6-OXO-4-(4-PHENYLMETHOXYPHENYL)-4,5-DIHYDROPYRIDINE-3-CARBOXYLATE?
The molecular formula of ETHYL 1-[2-(4-BENZYL-PIPERIDIN-1-YL)-2-OXO-ETHYL]-2-METHYL-6-OXO-4-(4-PHENYLMETHOXYPHENYL)-4,5-DIHYDROPYRIDINE-3-CARBOXYLATE is C36H40N2O5.
What is the molecular weight of ETHYL 1-[2-(4-BENZYL-PIPERIDIN-1-YL)-2-OXO-ETHYL]-2-METHYL-6-OXO-4-(4-PHENYLMETHOXYPHENYL)-4,5-DIHYDROPYRIDINE-3-CARBOXYLATE?
The molecular weight of ETHYL 1-[2-(4-BENZYL-PIPERIDIN-1-YL)-2-OXO-ETHYL]-2-METHYL-6-OXO-4-(4-PHENYLMETHOXYPHENYL)-4,5-DIHYDROPYRIDINE-3-CARBOXYLATE is 580.29 g/mol.
Where can I buy ETHYL 1-[2-(4-BENZYL-PIPERIDIN-1-YL)-2-OXO-ETHYL]-2-METHYL-6-OXO-4-(4-PHENYLMETHOXYPHENYL)-4,5-DIHYDROPYRIDINE-3-CARBOXYLATE?
You can request a quote for ETHYL 1-[2-(4-BENZYL-PIPERIDIN-1-YL)-2-OXO-ETHYL]-2-METHYL-6-OXO-4-(4-PHENYLMETHOXYPHENYL)-4,5-DIHYDROPYRIDINE-3-CARBOXYLATE directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ETHYL 1-[2-(4-BENZYL-PIPERIDIN-1-YL)-2-OXO-ETHYL]-2-METHYL-6-OXO-4-(4-PHENYLMETHOXYPHENYL)-4,5-DIHYDROPYRIDINE-3-CARBOXYLATE?
Yes, KEHONG BIO provides custom synthesis services for ETHYL 1-[2-(4-BENZYL-PIPERIDIN-1-YL)-2-OXO-ETHYL]-2-METHYL-6-OXO-4-(4-PHENYLMETHOXYPHENYL)-4,5-DIHYDROPYRIDINE-3-CARBOXYLATE and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.