RefChem:324167
TL;DR: RefChem:324167 (CAS 43060-56-6) is a chemical compound with molecular formula C32H46CaN4O8 and molecular weight 654.29 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
calcium bis(2-[4-[2-[2-(diethylamino)ethylamino]-2-oxoethoxy]phenyl]acetate)
Also Known As: ISONOX(R) 232, Benzeneacetic acid, 4-(2-((2-(diethylamino)ethyl)amino)-2-oxoethoxy)-, calcium salt, dihydrate, 4-(2-((2-(Diethylamino)ethyl)amino)-2-oxoethoxy)benzeneacetic acid calcium salt dihydrate, calcium 2-[4-[2-(2-diethylaminoethylamino)-2-oxoethoxy]phenyl]acetate, calcium,2-[4-[2-[2-(diethylamino)ethylamino]-2-oxoethoxy]phenyl]acetate
| Molecular Formula | C32H46CaN4O8 |
|---|---|
| Molecular Weight | 654.29 g/mol |
| LogP | -0.7492 |
| Topological Polar Surface Area | 163.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 18 |
| Exact Mass | 654.2941 |
| Heavy Atoms | 45 |
| Complexity | 332.0 |
Chemical Identifiers
| CAS Number | 43060-56-6 |
|---|---|
| SMILES | CCN(CC)CCNC(=O)COC1=CC=C(C=C1)CC(=O)[O-].CCN(CC)CCNC(=O)COC1=CC=C(C=C1)CC(=O)[O-].[Ca+2] |
| InChIKey | HXZSOOZVKBBKFU-UHFFFAOYSA-L |
Product Overview
RefChem:324167 (CAS 43060-56-6), with molecular formula C32H46CaN4O8 and molecular weight 654.29 g/mol. IUPAC: calcium bis(2-[4-[2-[2-(diethylamino)ethylamino]-2-oxoethoxy]phenyl]acetate).
Chemical Property Profile of RefChem:324167
Property Insights of RefChem:324167
The XLogP value of -0.7492 indicates that RefChem:324167 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 163.0 Ų indicates high polarity, suggesting RefChem:324167 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:324167 has 2 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:324167?
The CAS number of RefChem:324167 is 43060-56-6.
What is the molecular formula of RefChem:324167?
The molecular formula of RefChem:324167 is C32H46CaN4O8.
What is the molecular weight of RefChem:324167?
The molecular weight of RefChem:324167 is 654.29 g/mol.
Where can I buy RefChem:324167?
You can request a quote for RefChem:324167 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:324167?
Yes, KEHONG BIO provides custom synthesis services for RefChem:324167 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.