Hoe 892
TL;DR: Hoe 892 (CAS 75111-35-2) 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-[[(3aR,4R,5R,6aS)-5-hydroxy-4-[(E,3S)-3-hydroxyoct-1-enyl]-3,3a,4,5,6,6a-hexahydrocyclopenta[b]pyrrol-2-yl]sulfanyl]butanoate
Also Known As: Tilsuprost, Tilsuprostum, Hoe 892, beta-Thia-imino-prostacyclin, Tilsuprost [INN]
| 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 | 75111-35-2 |
|---|---|
| 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
Hoe 892 (CAS 75111-35-2), with molecular formula C20H33NO4S and molecular weight 383.21 g/mol. IUPAC: methyl 4-[[(3aR,4R,5R,6aS)-5-hydroxy-4-[(E,3S)-3-hydroxyoct-1-enyl]-3,3a,4,5,6,6a-hexahydrocyclopenta[b]pyrrol-2-yl]sulfanyl]butanoate.
Chemical Property Profile of Hoe 892
Property Insights of Hoe 892
The XLogP value of 3.338 indicates that Hoe 892 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 Hoe 892. Following Lipinski's Rule of Five, Hoe 892 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 Hoe 892?
The CAS number of Hoe 892 is 75111-35-2.
What is the molecular formula of Hoe 892?
The molecular formula of Hoe 892 is C20H33NO4S.
What is the molecular weight of Hoe 892?
The molecular weight of Hoe 892 is 383.21 g/mol.
Where can I buy Hoe 892?
You can request a quote for Hoe 892 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Hoe 892?
Yes, KEHONG BIO provides custom synthesis services for Hoe 892 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.