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Ethyl 4-[2-(4-methylpiperidin-1-YL)acetamido]benzoate
TL;DR: Ethyl 4-[2-(4-methylpiperidin-1-YL)acetamido]benzoate (CAS 712309-80-3) is a chemical compound with molecular formula C17H24N2O3 and molecular weight 304.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[[2-(4-methylpiperidin-1-yl)acetyl]amino]benzoate
Also Known As: ethyl 4-[2-(4-methylpiperidyl)acetylamino]benzoate, ETHYL 4-[2-(4-METHYLPIPERIDIN-1-YL)ACETAMIDO]BENZOATE, ethyl 4-[[2-(4-methylpiperidin-1-yl)acetyl]amino]benzoate, ethyl 4-(2-(4-methylpiperidin-1-yl)acetamido)benzoate, ethyl 4-{[(4-methylpiperidin-1-yl)acetyl]amino}benzoate
| Molecular Formula | C17H24N2O3 |
|---|---|
| Molecular Weight | 304.18 g/mol |
| LogP | 2.5337 |
| Topological Polar Surface Area | 58.64 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 304.17868 |
| Heavy Atoms | 22 |
| Complexity | 505.14026 |
Chemical Identifiers
| CAS Number | 712309-80-3 |
|---|---|
| SMILES | CCOC(=O)C1=CC=C(C=C1)NC(=O)CN2CCC(CC2)C |
Product Overview
Ethyl 4-[2-(4-methylpiperidin-1-YL)acetamido]benzoate (CAS 712309-80-3), with molecular formula C17H24N2O3 and molecular weight 304.18 g/mol. IUPAC: ethyl 4-[[2-(4-methylpiperidin-1-yl)acetyl]amino]benzoate.
Chemical Property Profile of Ethyl 4-[2-(4-methylpiperidin-1-YL)acetamido]benzoate
Property Insights of Ethyl 4-[2-(4-methylpiperidin-1-YL)acetamido]benzoate
The XLogP value of 2.5337 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 4-[2-(4-methylpiperidin-1-YL)acetamido]benzoate. With a topological polar surface area (TPSA) of 58.64 Ų, Ethyl 4-[2-(4-methylpiperidin-1-YL)acetamido]benzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 4-[2-(4-methylpiperidin-1-YL)acetamido]benzoate has 1 hydrogen bond donor(s) and 4 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 4-[2-(4-methylpiperidin-1-YL)acetamido]benzoate?
The CAS number of Ethyl 4-[2-(4-methylpiperidin-1-YL)acetamido]benzoate is 712309-80-3.
What is the molecular formula of Ethyl 4-[2-(4-methylpiperidin-1-YL)acetamido]benzoate?
The molecular formula of Ethyl 4-[2-(4-methylpiperidin-1-YL)acetamido]benzoate is C17H24N2O3.
What is the molecular weight of Ethyl 4-[2-(4-methylpiperidin-1-YL)acetamido]benzoate?
The molecular weight of Ethyl 4-[2-(4-methylpiperidin-1-YL)acetamido]benzoate is 304.18 g/mol.
Where can I buy Ethyl 4-[2-(4-methylpiperidin-1-YL)acetamido]benzoate?
You can request a quote for Ethyl 4-[2-(4-methylpiperidin-1-YL)acetamido]benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 4-[2-(4-methylpiperidin-1-YL)acetamido]benzoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 4-[2-(4-methylpiperidin-1-YL)acetamido]benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.