Gadolinium texaphyrin
TL;DR: Gadolinium texaphyrin (CAS 156436-89-4) is a chemical compound with molecular formula C52H72GdN5O14 and molecular weight 1148.4316 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[4,5-diethyl-24-(3-hydroxypropyl)-16,17-bis[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-10,23-dimethyl-13,20,25,26-tetraza-27-azanidapentacyclo[20.2.1.13,6.18,11.014,19]heptacosa-1(25),2,4,6,8(26),9,11,13,15,17,19,21,23-tridecaen-9-yl]propan-1-ol;gadolinium(3+);diacetate
Also Known As: Motexafin gadolinium, Gd texaphyrin, Xcytrin, Gadolinium texaphyrin, GD-Tex
Technical Specifications
| Molecular Formula | C52H72GdN5O14 |
| Molecular Weight | 1148.4316 g/mol |
| XLogP | 4.1284 |
| Topological Polar Surface Area (TPSA) | 245.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 19 |
| Rotatable Bonds | 28 |
| Exact Mass | 1148.4316 Da |
| Heavy Atoms | 72 |
| Complexity | 1900.0 |
| SMILES | CCC1=C(C2=CC3=NC(=CN=C4C=C(C(=CC4=NC=C5C(=C(C(=N5)C=C1[N-]2)CCCO)C)OCCOCCOCCOC)OCCOCCOCCOC)C(=C3CCCO)C)CC.CC(=O)[O-].CC(=O)[O-].[Gd+3] |
| InChIKey | VAZLWPAHMORDGR-UHFFFAOYSA-L |
Chemical Property Profile of Gadolinium texaphyrin
Property Insights of Gadolinium texaphyrin
The XLogP value of 4.1284 indicates that Gadolinium texaphyrin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 245.0 Ų indicates high polarity, suggesting Gadolinium texaphyrin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Gadolinium texaphyrin has 2 hydrogen bond donor(s) and 19 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Gadolinium texaphyrin?
The CAS number of Gadolinium texaphyrin is 156436-89-4.
What is the molecular formula of Gadolinium texaphyrin?
The molecular formula of Gadolinium texaphyrin is C52H72GdN5O14.
What is the molecular weight of Gadolinium texaphyrin?
The molecular weight of Gadolinium texaphyrin is 1148.4316 g/mol.
Where can I buy Gadolinium texaphyrin?
You can request a quote for Gadolinium texaphyrin directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Gadolinium texaphyrin?
Yes, CoreyChem provides custom synthesis services for Gadolinium texaphyrin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.