![[2-(4-Benzylpiperidin-1-yl)-2-oxoethyl] 2-methylbenzoate structure](/static/products/6554/6554-21-8.webp)
[2-(4-Benzylpiperidin-1-yl)-2-oxoethyl] 2-methylbenzoate
TL;DR: [2-(4-Benzylpiperidin-1-yl)-2-oxoethyl] 2-methylbenzoate (CAS 6554-21-8) is a chemical compound with molecular formula C22H25NO3 and molecular weight 351.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(4-benzylpiperidin-1-yl)-2-oxoethyl] 2-methylbenzoate
Also Known As: 3'-O-Acetyladenosin, [2-(4-benzylpiperidin-1-yl)-2-oxoethyl] 2-methylbenzoate, AB00710549-01, 2-(4-benzylpiperidin-1-yl)-2-oxoethyl 2-methylbenzoate
| Molecular Formula | C22H25NO3 |
|---|---|
| Molecular Weight | 351.18 g/mol |
| LogP | 3.63312 |
| Topological Polar Surface Area | 46.61 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 351.18344 |
| Heavy Atoms | 26 |
| Complexity | 748.9925 |
Chemical Identifiers
| CAS Number | 6554-21-8 |
|---|---|
| SMILES | CC1=CC=CC=C1C(=O)OCC(=O)N2CCC(CC2)CC3=CC=CC=C3 |
Product Overview
[2-(4-Benzylpiperidin-1-yl)-2-oxoethyl] 2-methylbenzoate (CAS 6554-21-8), with molecular formula C22H25NO3 and molecular weight 351.18 g/mol. IUPAC: [2-(4-benzylpiperidin-1-yl)-2-oxoethyl] 2-methylbenzoate.
Chemical Property Profile of [2-(4-Benzylpiperidin-1-yl)-2-oxoethyl] 2-methylbenzoate
Property Insights of [2-(4-Benzylpiperidin-1-yl)-2-oxoethyl] 2-methylbenzoate
The XLogP value of 3.63312 indicates that [2-(4-Benzylpiperidin-1-yl)-2-oxoethyl] 2-methylbenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.61 Ų, [2-(4-Benzylpiperidin-1-yl)-2-oxoethyl] 2-methylbenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [2-(4-Benzylpiperidin-1-yl)-2-oxoethyl] 2-methylbenzoate has 0 hydrogen bond donor(s) and 3 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 [2-(4-Benzylpiperidin-1-yl)-2-oxoethyl] 2-methylbenzoate?
The CAS number of [2-(4-Benzylpiperidin-1-yl)-2-oxoethyl] 2-methylbenzoate is 6554-21-8.
What is the molecular formula of [2-(4-Benzylpiperidin-1-yl)-2-oxoethyl] 2-methylbenzoate?
The molecular formula of [2-(4-Benzylpiperidin-1-yl)-2-oxoethyl] 2-methylbenzoate is C22H25NO3.
What is the molecular weight of [2-(4-Benzylpiperidin-1-yl)-2-oxoethyl] 2-methylbenzoate?
The molecular weight of [2-(4-Benzylpiperidin-1-yl)-2-oxoethyl] 2-methylbenzoate is 351.18 g/mol.
Where can I buy [2-(4-Benzylpiperidin-1-yl)-2-oxoethyl] 2-methylbenzoate?
You can request a quote for [2-(4-Benzylpiperidin-1-yl)-2-oxoethyl] 2-methylbenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [2-(4-Benzylpiperidin-1-yl)-2-oxoethyl] 2-methylbenzoate?
Yes, KEHONG BIO provides custom synthesis services for [2-(4-Benzylpiperidin-1-yl)-2-oxoethyl] 2-methylbenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.