Oxalic acid--4-(1-benzylpiperidin-3-yl)-1,2-phenylene diacetate (1/1)
TL;DR: Oxalic acid--4-(1-benzylpiperidin-3-yl)-1,2-phenylene diacetate (1/1) (CAS 61832-65-3) is a chemical compound with molecular formula C24H27NO8 and molecular weight 457.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-acetyloxy-4-(1-benzylpiperidin-3-yl)phenyl] acetate;oxalic acid
Also Known As: N-Benzyl-3-(3',4'-diacetoxyphenyl)piperidine oxalate, 4-(1-(Phenylmethyl)-3-piperidinyl)-1,2-benzenediol diacetate (ester) ethanedioate (1:1), N-benzyl-3-(3',4'-diacetoxyphenyl)-piperidine oxalate, 1,2-Benzenediol, 4-(1-(phenylmethyl)-3-piperidinyl)-, diacetate (ester), ethanedioate (1:1), Oxalic acid--4-(1-benzylpiperidin-3-yl)-1,2-phenylene diacetate (1/1)
| Molecular Formula | C24H27NO8 |
|---|---|
| Molecular Weight | 457.17 g/mol |
| LogP | 3.0724 |
| Topological Polar Surface Area | 130.44 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 457.17368 |
| Heavy Atoms | 33 |
| Complexity | 977.2137 |
Chemical Identifiers
| CAS Number | 61832-65-3 |
|---|---|
| SMILES | CC(=O)OC1=C(C=C(C=C1)C2CCCN(C2)CC3=CC=CC=C3)OC(=O)C.C(=O)(C(=O)O)O |
Product Overview
Oxalic acid--4-(1-benzylpiperidin-3-yl)-1,2-phenylene diacetate (1/1) (CAS 61832-65-3), with molecular formula C24H27NO8 and molecular weight 457.17 g/mol. IUPAC: [2-acetyloxy-4-(1-benzylpiperidin-3-yl)phenyl] acetate;oxalic acid.
Chemical Property Profile of Oxalic acid--4-(1-benzylpiperidin-3-yl)-1,2-phenylene diacetate (1/1)
Property Insights of Oxalic acid--4-(1-benzylpiperidin-3-yl)-1,2-phenylene diacetate (1/1)
The XLogP value of 3.0724 indicates that Oxalic acid--4-(1-benzylpiperidin-3-yl)-1,2-phenylene diacetate (1/1) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 130.44 Ų falls within the moderate polarity range, balancing permeability and solubility for Oxalic acid--4-(1-benzylpiperidin-3-yl)-1,2-phenylene diacetate (1/1). Following Lipinski's Rule of Five, Oxalic acid--4-(1-benzylpiperidin-3-yl)-1,2-phenylene diacetate (1/1) has 2 hydrogen bond donor(s) and 7 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 Oxalic acid--4-(1-benzylpiperidin-3-yl)-1,2-phenylene diacetate (1/1)?
The CAS number of Oxalic acid--4-(1-benzylpiperidin-3-yl)-1,2-phenylene diacetate (1/1) is 61832-65-3.
What is the molecular formula of Oxalic acid--4-(1-benzylpiperidin-3-yl)-1,2-phenylene diacetate (1/1)?
The molecular formula of Oxalic acid--4-(1-benzylpiperidin-3-yl)-1,2-phenylene diacetate (1/1) is C24H27NO8.
What is the molecular weight of Oxalic acid--4-(1-benzylpiperidin-3-yl)-1,2-phenylene diacetate (1/1)?
The molecular weight of Oxalic acid--4-(1-benzylpiperidin-3-yl)-1,2-phenylene diacetate (1/1) is 457.17 g/mol.
Where can I buy Oxalic acid--4-(1-benzylpiperidin-3-yl)-1,2-phenylene diacetate (1/1)?
You can request a quote for Oxalic acid--4-(1-benzylpiperidin-3-yl)-1,2-phenylene diacetate (1/1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Oxalic acid--4-(1-benzylpiperidin-3-yl)-1,2-phenylene diacetate (1/1)?
Yes, KEHONG BIO provides custom synthesis services for Oxalic acid--4-(1-benzylpiperidin-3-yl)-1,2-phenylene diacetate (1/1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.