Ioflupane I-123
TL;DR: Ioflupane I-123 (CAS 155798-07-5) is a chemical compound with molecular formula C18H23FINO2 and molecular weight 427.07687 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl (1R,2S,3S,5S)-8-(3-fluoropropyl)-3-(4-iodophenyl)-8-azabicyclo[3.2.1]octane-2-carboxylate
Also Known As: 123I-Ioflupane, DaTSCAN, ioflupane (123I), IOFLUPANE I 123, IOFLUPANE I-123
Technical Specifications
| Molecular Formula | C18H23FINO2 |
| Molecular Weight | 427.07687 g/mol |
| XLogP | 4.0 |
| Topological Polar Surface Area (TPSA) | 29.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 427.07687 Da |
| Heavy Atoms | 23 |
| Complexity | 414.0 |
| SMILES | COC(=O)[C@@H]1[C@H]2CC[C@H](N2CCCF)C[C@@H]1C3=CC=C(C=C3)[123I] |
| InChIKey | HXWLAJVUJSVENX-HFIFKADTSA-N |
Chemical Property Profile of Ioflupane I-123
Property Insights of Ioflupane I-123
The XLogP value of 4.0 indicates that Ioflupane I-123 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.5 Ų, Ioflupane I-123 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ioflupane I-123 has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Ioflupane I-123?
The CAS number of Ioflupane I-123 is 155798-07-5.
What is the molecular formula of Ioflupane I-123?
The molecular formula of Ioflupane I-123 is C18H23FINO2.
What is the molecular weight of Ioflupane I-123?
The molecular weight of Ioflupane I-123 is 427.07687 g/mol.
Where can I buy Ioflupane I-123?
You can request a quote for Ioflupane I-123 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Ioflupane I-123?
Yes, CoreyChem provides custom synthesis services for Ioflupane I-123 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.