1-(4-(palmitamido)phenyl)EDTA
TL;DR: 1-(4-(palmitamido)phenyl)EDTA (CAS 92195-06-7) is a chemical compound with molecular formula C32H51N3O9 and molecular weight 621.36 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[2-[bis(carboxymethyl)amino]-2-[4-(hexadecanoylamino)phenyl]ethyl]-(carboxymethyl)amino]acetic acid
Also Known As: 1-(p-(Palmitamido)phenyl)edta, 1-(4-(Palmitamido)phenyl)edta, 1-(4-(Palmitamido)phenyl)ethylenedinitrilo-tetraacetic acid, 2,2',2'',2'''-({1-[4-(hexadecanoylamino)phenyl]ethane-1,2-diyl}dinitrilo)tetraacetic acid, 1-[p-(palmitamido)-phenyl]ethylenedinitrilotetraacetic acid
| Molecular Formula | C32H51N3O9 |
|---|---|
| Molecular Weight | 621.36 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 185.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 27 |
| Exact Mass | 621.36255 |
| Heavy Atoms | 44 |
| Complexity | 830.0 |
Chemical Identifiers
| CAS Number | 92195-06-7 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCC(=O)NC1=CC=C(C=C1)C(CN(CC(=O)O)CC(=O)O)N(CC(=O)O)CC(=O)O |
| InChIKey | DOPZXCMJZIRSMZ-UHFFFAOYSA-N |
Product Overview
1-(4-(palmitamido)phenyl)EDTA (CAS 92195-06-7), with molecular formula C32H51N3O9 and molecular weight 621.36 g/mol. IUPAC: 2-[[2-[bis(carboxymethyl)amino]-2-[4-(hexadecanoylamino)phenyl]ethyl]-(carboxymethyl)amino]acetic acid.
Chemical Property Profile of 1-(4-(palmitamido)phenyl)EDTA
Property Insights of 1-(4-(palmitamido)phenyl)EDTA
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-(palmitamido)phenyl)EDTA. The TPSA of 185.0 Ų indicates high polarity, suggesting 1-(4-(palmitamido)phenyl)EDTA may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1-(4-(palmitamido)phenyl)EDTA has 5 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-(4-(palmitamido)phenyl)EDTA?
The CAS number of 1-(4-(palmitamido)phenyl)EDTA is 92195-06-7.
What is the molecular formula of 1-(4-(palmitamido)phenyl)EDTA?
The molecular formula of 1-(4-(palmitamido)phenyl)EDTA is C32H51N3O9.
What is the molecular weight of 1-(4-(palmitamido)phenyl)EDTA?
The molecular weight of 1-(4-(palmitamido)phenyl)EDTA is 621.36 g/mol.
Where can I buy 1-(4-(palmitamido)phenyl)EDTA?
You can request a quote for 1-(4-(palmitamido)phenyl)EDTA directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-(palmitamido)phenyl)EDTA?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-(palmitamido)phenyl)EDTA and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.