Phenolphthalein-glucuronide
TL;DR: Phenolphthalein-glucuronide (CAS 15265-26-6) is a chemical compound with molecular formula C26H22O10 and molecular weight 494.1213 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3,4,5-trihydroxy-6-[4-[1-(4-hydroxyphenyl)-3-oxo-2-benzofuran-1-yl]phenoxy]oxane-2-carboxylic acid
Also Known As: Phenolphthalein glucuronide, phenolphthalein-glucuronide, Phenolphthalein glucuronic acid, phenolphthalein-beta-d-glucuronide, phenolphthalein-beta-d-glucuronic acid
Technical Specifications
| Molecular Formula | C26H22O10 |
| Molecular Weight | 494.1213 g/mol |
| XLogP | 2.3 |
| Topological Polar Surface Area (TPSA) | 163.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 5 |
| Exact Mass | 494.1213 Da |
| Heavy Atoms | 36 |
| Complexity | 805.0 |
| SMILES | C1=CC=C2C(=C1)C(=O)OC2(C3=CC=C(C=C3)O)C4=CC=C(C=C4)OC5C(C(C(C(O5)C(=O)O)O)O)O |
| InChIKey | FXJYOZKDDSONLX-UHFFFAOYSA-N |
Chemical Property Profile of Phenolphthalein-glucuronide
Property Insights of Phenolphthalein-glucuronide
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phenolphthalein-glucuronide. The TPSA of 163.0 Ų indicates high polarity, suggesting Phenolphthalein-glucuronide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Phenolphthalein-glucuronide has 5 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Phenolphthalein-glucuronide?
The CAS number of Phenolphthalein-glucuronide is 15265-26-6.
What is the molecular formula of Phenolphthalein-glucuronide?
The molecular formula of Phenolphthalein-glucuronide is C26H22O10.
What is the molecular weight of Phenolphthalein-glucuronide?
The molecular weight of Phenolphthalein-glucuronide is 494.1213 g/mol.
Where can I buy Phenolphthalein-glucuronide?
You can request a quote for Phenolphthalein-glucuronide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Phenolphthalein-glucuronide?
Yes, CoreyChem provides custom synthesis services for Phenolphthalein-glucuronide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.