Raloxifene-4'-Ethyl Ether
TL;DR: Raloxifene-4'-Ethyl Ether (CAS 1026927-78-5) is a chemical compound with molecular formula C30H31NO4S and molecular weight 501.1974 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[2-(4-ethoxyphenyl)-6-hydroxy-1-benzothiophen-3-yl]-[4-(2-piperidin-1-ylethoxy)phenyl]methanone
Also Known As: Raloxifene Impurity 12, Raloxifene Impurity 26, Raloxifene-4'-Ethyl Ether, Raloxifene 4'-Ethoxy Analog, (2-(4-Ethoxyphenyl)-6-hydroxybenzo[b]thiophen-3-yl)(4-(2-(piperidin-1-yl)ethoxy) phenyl)methanone
Technical Specifications
| Molecular Formula | C30H31NO4S |
| Molecular Weight | 501.1974 g/mol |
| XLogP | 6.8 |
| Topological Polar Surface Area (TPSA) | 87.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 501.1974 Da |
| Heavy Atoms | 36 |
| Complexity | 684.0 |
| SMILES | CCOC1=CC=C(C=C1)C2=C(C3=C(S2)C=C(C=C3)O)C(=O)C4=CC=C(C=C4)OCCN5CCCCC5 |
| InChIKey | GFIFDOQEDRZDES-UHFFFAOYSA-N |
Chemical Property Profile of Raloxifene-4'-Ethyl Ether
Property Insights of Raloxifene-4'-Ethyl Ether
The XLogP value of 6.8 indicates that Raloxifene-4'-Ethyl Ether is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 87.2 Ų falls within the moderate polarity range, balancing permeability and solubility for Raloxifene-4'-Ethyl Ether. Following Lipinski's Rule of Five, Raloxifene-4'-Ethyl Ether has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Raloxifene-4'-Ethyl Ether?
The CAS number of Raloxifene-4'-Ethyl Ether is 1026927-78-5.
What is the molecular formula of Raloxifene-4'-Ethyl Ether?
The molecular formula of Raloxifene-4'-Ethyl Ether is C30H31NO4S.
What is the molecular weight of Raloxifene-4'-Ethyl Ether?
The molecular weight of Raloxifene-4'-Ethyl Ether is 501.1974 g/mol.
Where can I buy Raloxifene-4'-Ethyl Ether?
You can request a quote for Raloxifene-4'-Ethyl Ether directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Raloxifene-4'-Ethyl Ether?
Yes, CoreyChem provides custom synthesis services for Raloxifene-4'-Ethyl Ether and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.