Piperidine, 1-(6-(1,3-benzodioxol-5-yl)-4-(2-(1,3-benzodioxol-5-yl)ethyl)hexyl)-, 2-hydroxy-1,2,3-propanetricarboxylate (salt)
TL;DR: Piperidine, 1-(6-(1,3-benzodioxol-5-yl)-4-(2-(1,3-benzodioxol-5-yl)ethyl)hexyl)-, 2-hydroxy-1,2,3-propanetricarboxylate (salt) (CAS 57165-52-3) is a chemical compound with molecular formula C33H43NO11 and molecular weight 629.28 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[6-(1,3-benzodioxol-5-yl)-4-[2-(1,3-benzodioxol-5-yl)ethyl]hexyl]piperidine;2-hydroxypropane-1,2,3-tricarboxylic acid
Also Known As: Piperidine, 1-(6-(1,3-benzodioxol-5-yl)-4-(2-(1,3-benzodioxol-5-yl)ethyl)hexyl)-, 2-hydroxy-1,2,3-propanetricarboxylate (salt), 1-[6-(1,3-benzodioxol-5-yl)-4-[2-(1,3-benzodioxol-5-yl)ethyl]hexyl]piperidine; 2-hydroxypropane-1,2,3-tricarboxylic acid, 2-Hydroxypropane-1,2,3-tricarboxylic acid--1-{6-(2H-1,3-benzodioxol-5-yl)-4-[2-(2H-1,3-benzodioxol-5-yl)ethyl]hexyl}piperidine (1/1), RefChem:373122
| Molecular Formula | C33H43NO11 |
|---|---|
| Molecular Weight | 629.28 g/mol |
| LogP | 4.3432 |
| Topological Polar Surface Area | 172.29 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 15 |
| Exact Mass | 629.2836 |
| Heavy Atoms | 45 |
| Complexity | 1230.0533 |
Chemical Identifiers
| CAS Number | 57165-52-3 |
|---|---|
| SMILES | C1CCN(CC1)CCCC(CCC2=CC3=C(C=C2)OCO3)CCC4=CC5=C(C=C4)OCO5.C(C(=O)O)C(CC(=O)O)(C(=O)O)O |
Product Overview
Piperidine, 1-(6-(1,3-benzodioxol-5-yl)-4-(2-(1,3-benzodioxol-5-yl)ethyl)hexyl)-, 2-hydroxy-1,2,3-propanetricarboxylate (salt) (CAS 57165-52-3), with molecular formula C33H43NO11 and molecular weight 629.28 g/mol. IUPAC: 1-[6-(1,3-benzodioxol-5-yl)-4-[2-(1,3-benzodioxol-5-yl)ethyl]hexyl]piperidine;2-hydroxypropane-1,2,3-tricarboxylic acid.
Chemical Property Profile of Piperidine, 1-(6-(1,3-benzodioxol-5-yl)-4-(2-(1,3-benzodioxol-5-yl)ethyl)hexyl)-, 2-hydroxy-1,2,3-propanetricarboxylate (salt)
Property Insights of Piperidine, 1-(6-(1,3-benzodioxol-5-yl)-4-(2-(1,3-benzodioxol-5-yl)ethyl)hexyl)-, 2-hydroxy-1,2,3-propanetricarboxylate (salt)
The XLogP value of 4.3432 indicates that Piperidine, 1-(6-(1,3-benzodioxol-5-yl)-4-(2-(1,3-benzodioxol-5-yl)ethyl)hexyl)-, 2-hydroxy-1,2,3-propanetricarboxylate (salt) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 172.29 Ų indicates high polarity, suggesting Piperidine, 1-(6-(1,3-benzodioxol-5-yl)-4-(2-(1,3-benzodioxol-5-yl)ethyl)hexyl)-, 2-hydroxy-1,2,3-propanetricarboxylate (salt) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Piperidine, 1-(6-(1,3-benzodioxol-5-yl)-4-(2-(1,3-benzodioxol-5-yl)ethyl)hexyl)-, 2-hydroxy-1,2,3-propanetricarboxylate (salt) has 4 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Piperidine, 1-(6-(1,3-benzodioxol-5-yl)-4-(2-(1,3-benzodioxol-5-yl)ethyl)hexyl)-, 2-hydroxy-1,2,3-propanetricarboxylate (salt)?
The CAS number of Piperidine, 1-(6-(1,3-benzodioxol-5-yl)-4-(2-(1,3-benzodioxol-5-yl)ethyl)hexyl)-, 2-hydroxy-1,2,3-propanetricarboxylate (salt) is 57165-52-3.
What is the molecular formula of Piperidine, 1-(6-(1,3-benzodioxol-5-yl)-4-(2-(1,3-benzodioxol-5-yl)ethyl)hexyl)-, 2-hydroxy-1,2,3-propanetricarboxylate (salt)?
The molecular formula of Piperidine, 1-(6-(1,3-benzodioxol-5-yl)-4-(2-(1,3-benzodioxol-5-yl)ethyl)hexyl)-, 2-hydroxy-1,2,3-propanetricarboxylate (salt) is C33H43NO11.
What is the molecular weight of Piperidine, 1-(6-(1,3-benzodioxol-5-yl)-4-(2-(1,3-benzodioxol-5-yl)ethyl)hexyl)-, 2-hydroxy-1,2,3-propanetricarboxylate (salt)?
The molecular weight of Piperidine, 1-(6-(1,3-benzodioxol-5-yl)-4-(2-(1,3-benzodioxol-5-yl)ethyl)hexyl)-, 2-hydroxy-1,2,3-propanetricarboxylate (salt) is 629.28 g/mol.
Where can I buy Piperidine, 1-(6-(1,3-benzodioxol-5-yl)-4-(2-(1,3-benzodioxol-5-yl)ethyl)hexyl)-, 2-hydroxy-1,2,3-propanetricarboxylate (salt)?
You can request a quote for Piperidine, 1-(6-(1,3-benzodioxol-5-yl)-4-(2-(1,3-benzodioxol-5-yl)ethyl)hexyl)-, 2-hydroxy-1,2,3-propanetricarboxylate (salt) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Piperidine, 1-(6-(1,3-benzodioxol-5-yl)-4-(2-(1,3-benzodioxol-5-yl)ethyl)hexyl)-, 2-hydroxy-1,2,3-propanetricarboxylate (salt)?
Yes, KEHONG BIO provides custom synthesis services for Piperidine, 1-(6-(1,3-benzodioxol-5-yl)-4-(2-(1,3-benzodioxol-5-yl)ethyl)hexyl)-, 2-hydroxy-1,2,3-propanetricarboxylate (salt) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.