U46619
TL;DR: U46619 (CAS 76898-47-0) is a chemical compound with molecular formula C21H34O4 and molecular weight 350.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
U46619
(Z)-7-[(1R,4S,5S,6R)-6-[(E,3S)-3-hydroxyoct-1-enyl]-2-oxabicyclo[2.2.1]heptan-5-yl]hept-5-enoic acid
Also Known As: 9,11-Methanoepoxy PGH2, 9alpha-PGM, Thromboxane A2 agonist, 9,11-Epoxymethano-pgh2, 9,11-Methanoxy-PGH2
| Molecular Formula | C21H34O4 |
|---|---|
| Molecular Weight | 350.25 g/mol |
| LogP | 4.3361 |
| Topological Polar Surface Area | 66.76 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 12 |
| Exact Mass | 350.2457 |
| Heavy Atoms | 25 |
| Complexity | 456.8124 |
Chemical Identifiers
| CAS Number | 76898-47-0 |
|---|---|
| SMILES | CCCCC[C@@H](/C=C/[C@H]1[C@H]2C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)CO2)O |
Product Overview
U46619 (CAS 76898-47-0), with molecular formula C21H34O4 and molecular weight 350.25 g/mol. IUPAC: (Z)-7-[(1R,4S,5S,6R)-6-[(E,3S)-3-hydroxyoct-1-enyl]-2-oxabicyclo[2.2.1]heptan-5-yl]hept-5-enoic acid.
Chemical Property Profile of U46619
Property Insights of U46619
The XLogP value of 4.3361 indicates that U46619 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.76 Ų falls within the moderate polarity range, balancing permeability and solubility for U46619. Following Lipinski's Rule of Five, U46619 has 2 hydrogen bond donor(s) and 3 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 U46619?
The CAS number of U46619 is 76898-47-0.
What is the molecular formula of U46619?
The molecular formula of U46619 is C21H34O4.
What is the molecular weight of U46619?
The molecular weight of U46619 is 350.25 g/mol.
Where can I buy U46619?
You can request a quote for U46619 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for U46619?
Yes, KEHONG BIO provides custom synthesis services for U46619 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.