BAPTA tetraethyl ester
TL;DR: BAPTA tetraethyl ester (CAS 73630-07-6) is a chemical compound with molecular formula C30H40N2O10 and molecular weight 588.27 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[2-[2-[2-[bis(2-ethoxy-2-oxoethyl)amino]phenoxy]ethoxy]-N-(2-ethoxy-2-oxoethyl)anilino]acetate
Also Known As: BAPTA tetraethyl ester, Tetraethyl 2,2',2'',2'''-(((ethane-1,2-diylbis(oxy))bis(2,1-phenylene))bis(azanetriyl))tetraacetate, 1-(2-methoxy-4-methylphenyl)ethanone, ethyl 2-[2-[2-[2-[bis(2-ethoxy-2-oxoethyl)amino]phenoxy]ethoxy]-N-(2-ethoxy-2-oxoethyl)anilino]acetate, ethyl 2-{[2-(2-{2-[bis(2-ethoxy-2-oxoethyl)amino]phenoxy}ethoxy)phenyl](2-ethoxy-2-oxoethyl)amino}acetate
| Molecular Formula | C30H40N2O10 |
|---|---|
| Molecular Weight | 588.27 g/mol |
| LogP | 5.0 |
| Topological Polar Surface Area | 130.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 23 |
| Exact Mass | 588.2683 |
| Heavy Atoms | 42 |
| Complexity | 720.0 |
Chemical Identifiers
| CAS Number | 73630-07-6 |
|---|---|
| SMILES | CCOC(=O)CN(CC(=O)OCC)C1=CC=CC=C1OCCOC2=CC=CC=C2N(CC(=O)OCC)CC(=O)OCC |
| InChIKey | OLXCPQDFHUCXBA-UHFFFAOYSA-N |
Product Overview
BAPTA tetraethyl ester (CAS 73630-07-6), with molecular formula C30H40N2O10 and molecular weight 588.27 g/mol. IUPAC: ethyl 2-[2-[2-[2-[bis(2-ethoxy-2-oxoethyl)amino]phenoxy]ethoxy]-N-(2-ethoxy-2-oxoethyl)anilino]acetate.
Chemical Property Profile of BAPTA tetraethyl ester
Property Insights of BAPTA tetraethyl ester
The XLogP value of 5.0 indicates that BAPTA tetraethyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 130.0 Ų falls within the moderate polarity range, balancing permeability and solubility for BAPTA tetraethyl ester. Following Lipinski's Rule of Five, BAPTA tetraethyl ester has 0 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAPTA tetraethyl ester?
The CAS number of BAPTA tetraethyl ester is 73630-07-6.
What is the molecular formula of BAPTA tetraethyl ester?
The molecular formula of BAPTA tetraethyl ester is C30H40N2O10.
What is the molecular weight of BAPTA tetraethyl ester?
The molecular weight of BAPTA tetraethyl ester is 588.27 g/mol.
Where can I buy BAPTA tetraethyl ester?
You can request a quote for BAPTA tetraethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAPTA tetraethyl ester?
Yes, KEHONG BIO provides custom synthesis services for BAPTA tetraethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.