Alprostadil alfadex
TL;DR: Alprostadil alfadex (CAS 93591-00-5) is a chemical compound with molecular formula C56H94O35 and molecular weight 1326.56 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1S,3R,5R,6S,8R,10R,11S,13R,15R,16S,18R,20R,21S,23R,25R,26S,28R,30R,31R,32R,33R,34R,35R,36R,37R,38R,39R,40R,41R,42R)-5,10,15,20,25,30-hexakis(hydroxymethyl)-2,4,7,9,12,14,17,19,22,24,27,29-dodecaoxaheptacyclo[26.2.2.23,6.28,11.213,16.218,21.223,26]dotetracontane-31,32,33,34,35,36,37,38,39,40,41,42-dodecol;7-[(1R,2R,3R)-3-hydroxy-2-[(E,3S)-3-hydroxyoct-1-enyl]-5-oxocyclopentyl]heptanoic acid
Also Known As: Alprostadil alfadex, Tandetoron, Prostavasin, Edex, Tandetoron;
| Molecular Formula | C56H94O35 |
|---|---|
| Molecular Weight | 1326.56 g/mol |
| LogP | -9.5797 |
| Topological Polar Surface Area | 569.73 Ų |
| Hydrogen Bond Donors | 21 |
| Hydrogen Bond Acceptors | 34 |
| Rotatable Bonds | 19 |
| Exact Mass | 1326.5576 |
| Heavy Atoms | 91 |
| Complexity | 1918.2948 |
Chemical Identifiers
| CAS Number | 93591-00-5 |
|---|---|
| SMILES | CCCCC[C@@H](/C=C/[C@H]1[C@@H](CC(=O)[C@@H]1CCCCCCC(=O)O)O)O.C([C@@H]1[C@@H]2[C@@H]([C@H]([C@H](O1)O[C@@H]3[C@H](O[C@@H]([C@@H]([C@H]3O)O)O[C@@H]4[C@H](O[C@@H]([C@@H]([C@H]4O)O)O[C@@H]5[C@H](O[C@@H]([C@@H]([C@H]5O)O)O[C@@H]6[C@H](O[C@@H]([C@@H]([C@H]6O)O)O[C@@H]7[C@H](O[C@H](O2)[C@@H]([C@H]7O)O)CO)CO)CO)CO)CO)O)O)O |
Product Overview
Alprostadil alfadex (CAS 93591-00-5), with molecular formula C56H94O35 and molecular weight 1326.56 g/mol. IUPAC: (1S,3R,5R,6S,8R,10R,11S,13R,15R,16S,18R,20R,21S,23R,25R,26S,28R,30R,31R,32R,33R,34R,35R,36R,37R,38R,39R,40R,41R,42R)-5,10,15,20,25,30-hexakis(hydroxymethyl)-2,4,7,9,12,14,17,19,22,24,27,29-dodecaoxaheptacyclo[26.2.2.23,6.28,11.213,16.218,21.223,26]dotetracontane-31,32,33,34,35,36,37,38,39,40,41,42-dodecol;7-[(1R,2R,3R)-3-hydroxy-2-[(E,3S)-3-hydroxyoct-1-enyl]-5-oxocyclopentyl]heptanoic acid.
Chemical Property Profile of Alprostadil alfadex
Property Insights of Alprostadil alfadex
The XLogP value of -9.5797 indicates that Alprostadil alfadex is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 569.73 Ų indicates high polarity, suggesting Alprostadil alfadex may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Alprostadil alfadex has 21 hydrogen bond donor(s) and 34 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Alprostadil alfadex?
The CAS number of Alprostadil alfadex is 93591-00-5.
What is the molecular formula of Alprostadil alfadex?
The molecular formula of Alprostadil alfadex is C56H94O35.
What is the molecular weight of Alprostadil alfadex?
The molecular weight of Alprostadil alfadex is 1326.56 g/mol.
Where can I buy Alprostadil alfadex?
You can request a quote for Alprostadil alfadex directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Alprostadil alfadex?
Yes, KEHONG BIO provides custom synthesis services for Alprostadil alfadex and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.