MERALLURIDE
TL;DR: MERALLURIDE (CAS 113-50-8) is a chemical compound with molecular formula C16H22HgN6O7 and molecular weight 612.1257 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[3-(3-carboxypropanoylcarbamoylamino)-2-methoxypropyl]mercury(1+);1,3-dimethyl-2-oxopurin-6-olate
Also Known As: MERALLURIDE, [3-(3-carboxypropanoylcarbamoylamino)-2-methoxypropyl]mercury(1+);1,3-dimethyl-2-oxopurin-6-olate, 3-[3-(3-Carboxypropionyl)ureido]-2-methoxypropyl(1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo-7H-purin-, 1,3-dimethyl-2-oxopurin-6-olate; [3-[(4-hydroxy-4-oxobutanoyl)carbamoylamino]-2-methoxypropyl]mercury(1+)
Technical Specifications
| Molecular Formula | C16H22HgN6O7 |
| Molecular Weight | 612.1257 g/mol |
| XLogP | -1.6507 |
| Topological Polar Surface Area (TPSA) | 176.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 612.1257 Da |
| Heavy Atoms | 30 |
| Complexity | 653.0 |
| SMILES | CN1C(=C2C(=NC=N2)N(C1=O)C)[O-].COC(CNC(=O)NC(=O)CCC(=O)O)C[Hg+] |
| InChIKey | GIBHJHXHKFXGMX-UHFFFAOYSA-M |
Chemical Property Profile of MERALLURIDE
Property Insights of MERALLURIDE
The XLogP value of -1.6507 indicates that MERALLURIDE is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 176.0 Ų indicates high polarity, suggesting MERALLURIDE may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, MERALLURIDE has 3 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of MERALLURIDE?
The CAS number of MERALLURIDE is 113-50-8.
What is the molecular formula of MERALLURIDE?
The molecular formula of MERALLURIDE is C16H22HgN6O7.
What is the molecular weight of MERALLURIDE?
The molecular weight of MERALLURIDE is 612.1257 g/mol.
Where can I buy MERALLURIDE?
You can request a quote for MERALLURIDE directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for MERALLURIDE?
Yes, CoreyChem provides custom synthesis services for MERALLURIDE and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.