Pregabalin Impurity 16
TL;DR: Pregabalin Impurity 16 (CAS 501666-22-4) is a chemical compound with molecular formula C14H25NO6 and molecular weight 303.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4R)-4-(2-methylpropyl)-1-[[(2R,3S,4S,5R)-2,3,4,5-tetrahydroxyoxan-2-yl]methyl]pyrrolidin-2-one
Also Known As: Pregabalin Impurity 16, Pregabalin Impurity 66, Pregabalin Impurity PD0310806 (Pregabalin Impurity, (4R)-4-(2-methylpropyl)-1-[[(3S,4R,5R)-2,3,4,5-tetrahydroxyoxan-2-yl]methyl]pyrrolidin-2-one, (R)-4-isobutyl-1-(((2R,3S,4S,5R)-2,3,4,5-tetrahydroxytetrahydro-2H-pyran-2-yl)methyl)pyrrolidin-2-one
| Molecular Formula | C14H25NO6 |
|---|---|
| Molecular Weight | 303.17 g/mol |
| LogP | -1.3175 |
| Topological Polar Surface Area | 110.46 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 303.16818 |
| Heavy Atoms | 21 |
| Complexity | 389.66052 |
Chemical Identifiers
| CAS Number | 501666-22-4 |
|---|---|
| SMILES | CC(C)C[C@@H]1CC(=O)N(C1)C[C@@]2([C@H]([C@H]([C@@H](CO2)O)O)O)O |
Product Overview
Pregabalin Impurity 16 (CAS 501666-22-4), with molecular formula C14H25NO6 and molecular weight 303.17 g/mol. IUPAC: (4R)-4-(2-methylpropyl)-1-[[(2R,3S,4S,5R)-2,3,4,5-tetrahydroxyoxan-2-yl]methyl]pyrrolidin-2-one.
Chemical Property Profile of Pregabalin Impurity 16
Property Insights of Pregabalin Impurity 16
The XLogP value of -1.3175 indicates that Pregabalin Impurity 16 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 110.46 Ų falls within the moderate polarity range, balancing permeability and solubility for Pregabalin Impurity 16. Following Lipinski's Rule of Five, Pregabalin Impurity 16 has 4 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Pregabalin Impurity 16?
The CAS number of Pregabalin Impurity 16 is 501666-22-4.
What is the molecular formula of Pregabalin Impurity 16?
The molecular formula of Pregabalin Impurity 16 is C14H25NO6.
What is the molecular weight of Pregabalin Impurity 16?
The molecular weight of Pregabalin Impurity 16 is 303.17 g/mol.
Where can I buy Pregabalin Impurity 16?
You can request a quote for Pregabalin Impurity 16 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pregabalin Impurity 16?
Yes, KEHONG BIO provides custom synthesis services for Pregabalin Impurity 16 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.