Ethyl 1-(3,4,5-trimethoxybenzoyl)piperidine-3-carboxylate
TL;DR: Ethyl 1-(3,4,5-trimethoxybenzoyl)piperidine-3-carboxylate (CAS 349441-88-9) is a chemical compound with molecular formula C18H25NO6 and molecular weight 351.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 1-(3,4,5-trimethoxybenzoyl)piperidine-3-carboxylate
Also Known As: BAS 03033800, ethyl 1-(3,4,5-trimethoxybenzoyl)piperidine-3-carboxylate, ethyl 1-[(3,4,5-trimethoxyphenyl)carbonyl]piperidine-3-carboxylate, 1-(3,4,5-Trimethoxy-benzoyl)-piperidine-3-carboxylic acid ethyl ester
| Molecular Formula | C18H25NO6 |
|---|---|
| Molecular Weight | 351.17 g/mol |
| LogP | 2.1277 |
| Topological Polar Surface Area | 74.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 351.16818 |
| Heavy Atoms | 25 |
| Complexity | 604.9875 |
Chemical Identifiers
| CAS Number | 349441-88-9 |
|---|---|
| SMILES | CCOC(=O)C1CCCN(C1)C(=O)C2=CC(=C(C(=C2)OC)OC)OC |
Product Overview
Ethyl 1-(3,4,5-trimethoxybenzoyl)piperidine-3-carboxylate (CAS 349441-88-9), with molecular formula C18H25NO6 and molecular weight 351.17 g/mol. IUPAC: ethyl 1-(3,4,5-trimethoxybenzoyl)piperidine-3-carboxylate.
Chemical Property Profile of Ethyl 1-(3,4,5-trimethoxybenzoyl)piperidine-3-carboxylate
Property Insights of Ethyl 1-(3,4,5-trimethoxybenzoyl)piperidine-3-carboxylate
The XLogP value of 2.1277 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 1-(3,4,5-trimethoxybenzoyl)piperidine-3-carboxylate. The TPSA of 74.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 1-(3,4,5-trimethoxybenzoyl)piperidine-3-carboxylate. Following Lipinski's Rule of Five, Ethyl 1-(3,4,5-trimethoxybenzoyl)piperidine-3-carboxylate has 0 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 Ethyl 1-(3,4,5-trimethoxybenzoyl)piperidine-3-carboxylate?
The CAS number of Ethyl 1-(3,4,5-trimethoxybenzoyl)piperidine-3-carboxylate is 349441-88-9.
What is the molecular formula of Ethyl 1-(3,4,5-trimethoxybenzoyl)piperidine-3-carboxylate?
The molecular formula of Ethyl 1-(3,4,5-trimethoxybenzoyl)piperidine-3-carboxylate is C18H25NO6.
What is the molecular weight of Ethyl 1-(3,4,5-trimethoxybenzoyl)piperidine-3-carboxylate?
The molecular weight of Ethyl 1-(3,4,5-trimethoxybenzoyl)piperidine-3-carboxylate is 351.17 g/mol.
Where can I buy Ethyl 1-(3,4,5-trimethoxybenzoyl)piperidine-3-carboxylate?
You can request a quote for Ethyl 1-(3,4,5-trimethoxybenzoyl)piperidine-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-(3,4,5-trimethoxybenzoyl)piperidine-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 1-(3,4,5-trimethoxybenzoyl)piperidine-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.