Perisoxal
TL;DR: Perisoxal (CAS 5345-82-4) is a chemical compound with molecular formula C38H45N4O11-3 and molecular weight 733.31 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-hydroxypropane-1,2,3-tricarboxylate;bis(1-(5-phenyl-1,2-oxazol-3-yl)-2-piperidin-1-ylethanol)
Also Known As: Perisoxal, Isoxal, Perisoxal citrate, KST-1B4975, 2C16H20N2O2.C6H8O7
| Molecular Formula | C38H45N4O11-3 |
|---|---|
| Molecular Weight | 733.31 g/mol |
| LogP | 0.4692 |
| Topological Polar Surface Area | 240.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 15 |
| Rotatable Bonds | 10 |
| Exact Mass | 733.3085 |
| Heavy Atoms | 53 |
| Complexity | 499.0 |
Chemical Identifiers
| CAS Number | 5345-82-4 |
|---|---|
| SMILES | C1CCN(CC1)CC(C2=NOC(=C2)C3=CC=CC=C3)O.C1CCN(CC1)CC(C2=NOC(=C2)C3=CC=CC=C3)O.C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O |
| InChIKey | OOSOWXQJLLTIAF-UHFFFAOYSA-K |
Product Overview
Perisoxal (CAS 5345-82-4), with molecular formula C38H45N4O11-3 and molecular weight 733.31 g/mol. IUPAC: 2-hydroxypropane-1,2,3-tricarboxylate;bis(1-(5-phenyl-1,2-oxazol-3-yl)-2-piperidin-1-ylethanol).
Chemical Property Profile of Perisoxal
Property Insights of Perisoxal
The XLogP value of 0.4692 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Perisoxal. The TPSA of 240.0 Ų indicates high polarity, suggesting Perisoxal may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Perisoxal has 3 hydrogen bond donor(s) and 15 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Perisoxal?
The CAS number of Perisoxal is 5345-82-4.
What is the molecular formula of Perisoxal?
The molecular formula of Perisoxal is C38H45N4O11-3.
What is the molecular weight of Perisoxal?
The molecular weight of Perisoxal is 733.31 g/mol.
Where can I buy Perisoxal?
You can request a quote for Perisoxal directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Perisoxal?
Yes, KEHONG BIO provides custom synthesis services for Perisoxal and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.