2'-Iodospiperone
TL;DR: 2'-Iodospiperone (CAS 103446-46-4) is a chemical compound with molecular formula C23H25FIN3O2 and molecular weight 521.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-[4-(4-fluoro-2-iodophenyl)-4-oxobutyl]-1-phenyl-1,3,8-triazaspiro[4.5]decan-4-one
Also Known As: 2'-Iodospiperone, 2/'-Iodospiperone, 2'-Isp, 2 -Iodospiperone, 8-[4-(4-fluoro-2-iodophenyl)-4-oxobutyl]-1-phenyl-1,3,8-triazaspiro[4.5]decan-4-one
| Molecular Formula | C23H25FIN3O2 |
|---|---|
| Molecular Weight | 521.10 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 52.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 521.09753 |
| Heavy Atoms | 30 |
| Complexity | 620.0 |
Chemical Identifiers
| CAS Number | 103446-46-4 |
|---|---|
| SMILES | C1CN(CCC12C(=O)NCN2C3=CC=CC=C3)CCCC(=O)C4=C(C=C(C=C4)F)I |
| InChIKey | WNZBTQBAZJTZST-UHFFFAOYSA-N |
Product Overview
2'-Iodospiperone (CAS 103446-46-4), with molecular formula C23H25FIN3O2 and molecular weight 521.10 g/mol. IUPAC: 8-[4-(4-fluoro-2-iodophenyl)-4-oxobutyl]-1-phenyl-1,3,8-triazaspiro[4.5]decan-4-one.
Chemical Property Profile of 2'-Iodospiperone
Property Insights of 2'-Iodospiperone
The XLogP value of 3.7 indicates that 2'-Iodospiperone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.7 Ų, 2'-Iodospiperone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2'-Iodospiperone has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2'-Iodospiperone?
The CAS number of 2'-Iodospiperone is 103446-46-4.
What is the molecular formula of 2'-Iodospiperone?
The molecular formula of 2'-Iodospiperone is C23H25FIN3O2.
What is the molecular weight of 2'-Iodospiperone?
The molecular weight of 2'-Iodospiperone is 521.10 g/mol.
Where can I buy 2'-Iodospiperone?
You can request a quote for 2'-Iodospiperone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2'-Iodospiperone?
Yes, KEHONG BIO provides custom synthesis services for 2'-Iodospiperone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.