11-Methoxy-16-iodoestradiol
TL;DR: 11-Methoxy-16-iodoestradiol (CAS 104842-16-2) is a chemical compound with molecular formula C19H25IO3 and molecular weight 428.08484 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(8S,9S,11S,13S,14S,16R,17R)-16-iodo-11-methoxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,17-diol
Also Known As: 11-Methoxy-16-iodoestradiol, IMOE, 11-ME(2), 11beta-Methoxy-16alpha-123-I-iodoestradiol, 16alpha-Iodo-11beta-methoxy-17beta-estradiol
Technical Specifications
| Molecular Formula | C19H25IO3 |
| Molecular Weight | 428.08484 g/mol |
| XLogP | 3.9 |
| Topological Polar Surface Area (TPSA) | 49.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 428.08484 Da |
| Heavy Atoms | 23 |
| Complexity | 458.0 |
| SMILES | C[C@]12C[C@@H]([C@H]3[C@H]([C@@H]1C[C@H]([C@@H]2O)I)CCC4=C3C=CC(=C4)O)OC |
| InChIKey | ZKXIUQUNJAKYCW-RUOITVIXSA-N |
Chemical Property Profile of 11-Methoxy-16-iodoestradiol
Property Insights of 11-Methoxy-16-iodoestradiol
The XLogP value of 3.9 indicates that 11-Methoxy-16-iodoestradiol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.7 Ų, 11-Methoxy-16-iodoestradiol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 11-Methoxy-16-iodoestradiol 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
What is the CAS number of 11-Methoxy-16-iodoestradiol?
The CAS number of 11-Methoxy-16-iodoestradiol is 104842-16-2.
What is the molecular formula of 11-Methoxy-16-iodoestradiol?
The molecular formula of 11-Methoxy-16-iodoestradiol is C19H25IO3.
What is the molecular weight of 11-Methoxy-16-iodoestradiol?
The molecular weight of 11-Methoxy-16-iodoestradiol is 428.08484 g/mol.
Where can I buy 11-Methoxy-16-iodoestradiol?
You can request a quote for 11-Methoxy-16-iodoestradiol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 11-Methoxy-16-iodoestradiol?
Yes, CoreyChem provides custom synthesis services for 11-Methoxy-16-iodoestradiol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.