Perindoprilat glucuronide
TL;DR: Perindoprilat glucuronide (CAS 120381-56-8) is a chemical compound with molecular formula C23H36N2O11 and molecular weight 516.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R,3R,4S,5S,6R)-2-[(2S,3aS,7aS)-1-[2-(1-carboxypropylamino)propanoyl]-2,3,3a,4,5,6,7,7a-octahydroindole-2-carbonyl]oxy-3,4,5-trihydroxy-6-methyloxane-2-carboxylic acid
Also Known As: Perindoprilat glucuronide, Perindoprilat-glucuronide, Perindoprilat acyl glucuronide, Perindoprilat acyl-b-D-glucuronide, Perindoprilat Acyl-beta-D-glucuronide
| Molecular Formula | C23H36N2O11 |
|---|---|
| Molecular Weight | 516.23 g/mol |
| LogP | -1.9 |
| Topological Polar Surface Area | 203.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 9 |
| Exact Mass | 516.23193 |
| Heavy Atoms | 36 |
| Complexity | 869.0 |
Chemical Identifiers
| CAS Number | 120381-56-8 |
|---|---|
| SMILES | CCC(C(=O)O)NC(C)C(=O)N1[C@H]2CCCC[C@H]2C[C@H]1C(=O)O[C@]3([C@@H]([C@H]([C@@H]([C@H](O3)C)O)O)O)C(=O)O |
| InChIKey | DCYRDAKXQLERQS-FQCHSDBKSA-N |
Product Overview
Perindoprilat glucuronide (CAS 120381-56-8), with molecular formula C23H36N2O11 and molecular weight 516.23 g/mol. IUPAC: (2R,3R,4S,5S,6R)-2-[(2S,3aS,7aS)-1-[2-(1-carboxypropylamino)propanoyl]-2,3,3a,4,5,6,7,7a-octahydroindole-2-carbonyl]oxy-3,4,5-trihydroxy-6-methyloxane-2-carboxylic acid.
Chemical Property Profile of Perindoprilat glucuronide
Property Insights of Perindoprilat glucuronide
The XLogP value of -1.9 indicates that Perindoprilat glucuronide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 203.0 Ų indicates high polarity, suggesting Perindoprilat glucuronide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Perindoprilat glucuronide has 6 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 Perindoprilat glucuronide?
The CAS number of Perindoprilat glucuronide is 120381-56-8.
What is the molecular formula of Perindoprilat glucuronide?
The molecular formula of Perindoprilat glucuronide is C23H36N2O11.
What is the molecular weight of Perindoprilat glucuronide?
The molecular weight of Perindoprilat glucuronide is 516.23 g/mol.
Where can I buy Perindoprilat glucuronide?
You can request a quote for Perindoprilat glucuronide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Perindoprilat glucuronide?
Yes, KEHONG BIO provides custom synthesis services for Perindoprilat glucuronide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.