Tilsuprost
TL;DR: Tilsuprost (CAS 80225-28-1) is a chemical compound with molecular formula C20H33NO4S and molecular weight 383.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-[[(3aS,4S,5S,6aR)-5-hydroxy-4-[(E,3R)-3-hydroxyoct-1-enyl]-3,3a,4,5,6,6a-hexahydrocyclopenta[b]pyrrol-2-yl]sulfanyl]butanoate
Also Known As: Tilsuprost, methyl 4-[[(3aS,4S,5S,6aR)-5-hydroxy-4-[(E,3R)-3-hydroxyoct-, methyl 4-[[(3aS,4S,5S,6aR)-5-hydroxy-4-[(E,3R)-3-hydroxyoct-1-enyl]-3,3a,4,5,6,6a-hexahydrocyclopenta[b]pyrrol-2-yl]sulfanyl]butanoate
| Molecular Formula | C20H33NO4S |
|---|---|
| Molecular Weight | 383.21 g/mol |
| LogP | 3.338 |
| Topological Polar Surface Area | 79.12 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 10 |
| Exact Mass | 383.21304 |
| Heavy Atoms | 26 |
| Complexity | 508.03964 |
Chemical Identifiers
| CAS Number | 80225-28-1 |
|---|---|
| SMILES | CCCCC[C@H](/C=C/[C@@H]1[C@H](C[C@@H]2[C@H]1CC(=N2)SCCCC(=O)OC)O)O |
Product Overview
Tilsuprost (CAS 80225-28-1), with molecular formula C20H33NO4S and molecular weight 383.21 g/mol. IUPAC: methyl 4-[[(3aS,4S,5S,6aR)-5-hydroxy-4-[(E,3R)-3-hydroxyoct-1-enyl]-3,3a,4,5,6,6a-hexahydrocyclopenta[b]pyrrol-2-yl]sulfanyl]butanoate.
Chemical Property Profile of Tilsuprost
Property Insights of Tilsuprost
The XLogP value of 3.338 indicates that Tilsuprost is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.12 Ų falls within the moderate polarity range, balancing permeability and solubility for Tilsuprost. Following Lipinski's Rule of Five, Tilsuprost has 2 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 Tilsuprost?
The CAS number of Tilsuprost is 80225-28-1.
What is the molecular formula of Tilsuprost?
The molecular formula of Tilsuprost is C20H33NO4S.
What is the molecular weight of Tilsuprost?
The molecular weight of Tilsuprost is 383.21 g/mol.
Where can I buy Tilsuprost?
You can request a quote for Tilsuprost directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tilsuprost?
Yes, KEHONG BIO provides custom synthesis services for Tilsuprost and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.