Enisoprost
TL;DR: Enisoprost (CAS 81026-63-3) is a chemical compound with molecular formula C22H36O5 and molecular weight 380.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (Z)-7-[(1R,2R,3R)-3-hydroxy-2-[(E)-4-hydroxy-4-methyloct-1-enyl]-5-oxocyclopentyl]hept-4-enoate
Also Known As: Enisoprostum, Enisoprostum [Latin], Enisoprost [USAN:INN], ENISOPROST [INN], Enisoprost (USAN/INN)
| Molecular Formula | C22H36O5 |
|---|---|
| Molecular Weight | 380.26 g/mol |
| LogP | 3.7296 |
| Topological Polar Surface Area | 83.83 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 12 |
| Exact Mass | 380.2563 |
| Heavy Atoms | 27 |
| Complexity | 520.7962 |
Chemical Identifiers
| CAS Number | 81026-63-3 |
|---|---|
| SMILES | CCCCC(C)(C/C=C/[C@H]1[C@@H](CC(=O)[C@@H]1CC/C=C\CCC(=O)OC)O)O |
Product Overview
Enisoprost (CAS 81026-63-3), with molecular formula C22H36O5 and molecular weight 380.26 g/mol. IUPAC: methyl (Z)-7-[(1R,2R,3R)-3-hydroxy-2-[(E)-4-hydroxy-4-methyloct-1-enyl]-5-oxocyclopentyl]hept-4-enoate.
Chemical Property Profile of Enisoprost
Property Insights of Enisoprost
The XLogP value of 3.7296 indicates that Enisoprost is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.83 Ų falls within the moderate polarity range, balancing permeability and solubility for Enisoprost. Following Lipinski's Rule of Five, Enisoprost has 2 hydrogen bond donor(s) and 5 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 Enisoprost?
The CAS number of Enisoprost is 81026-63-3.
What is the molecular formula of Enisoprost?
The molecular formula of Enisoprost is C22H36O5.
What is the molecular weight of Enisoprost?
The molecular weight of Enisoprost is 380.26 g/mol.
Where can I buy Enisoprost?
You can request a quote for Enisoprost directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Enisoprost?
Yes, KEHONG BIO provides custom synthesis services for Enisoprost and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.