6-Iodoclorgyline
TL;DR: 6-Iodoclorgyline (CAS 140163-68-4) is a chemical compound with molecular formula C13H14Cl2INO and molecular weight 394.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2,4-dichloro-6-(125I)iodophenoxy)-N-methyl-N-prop-2-ynylpropan-1-amine
Also Known As: Iodoclorgyline, 6-Iodoclorgyline, (125I)-6-Iodoclorgyline, N-(3-(2,4-Dichloro-6-iodophenoxy)propyl)-N-methyl-2-propynylamine, 3-(2,4-dichloro-6-(125I)iodanylphenoxy)-N-methyl-N-prop-2-ynylpropan-1-amine
| Molecular Formula | C13H14Cl2INO |
|---|---|
| Molecular Weight | 394.95 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 12.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 394.9499 |
| Heavy Atoms | 18 |
| Complexity | 294.0 |
Chemical Identifiers
| CAS Number | 140163-68-4 |
|---|---|
| SMILES | CN(CCCOC1=C(C=C(C=C1[125I])Cl)Cl)CC#C |
| InChIKey | PFCHUBXBWDBDNO-RFLHHMENSA-N |
Product Overview
6-Iodoclorgyline (CAS 140163-68-4), with molecular formula C13H14Cl2INO and molecular weight 394.95 g/mol. IUPAC: 3-(2,4-dichloro-6-(125I)iodophenoxy)-N-methyl-N-prop-2-ynylpropan-1-amine.
Chemical Property Profile of 6-Iodoclorgyline
Property Insights of 6-Iodoclorgyline
The XLogP value of 4.3 indicates that 6-Iodoclorgyline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.5 Ų, 6-Iodoclorgyline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Iodoclorgyline has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 6-Iodoclorgyline?
The CAS number of 6-Iodoclorgyline is 140163-68-4.
What is the molecular formula of 6-Iodoclorgyline?
The molecular formula of 6-Iodoclorgyline is C13H14Cl2INO.
What is the molecular weight of 6-Iodoclorgyline?
The molecular weight of 6-Iodoclorgyline is 394.95 g/mol.
Where can I buy 6-Iodoclorgyline?
You can request a quote for 6-Iodoclorgyline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Iodoclorgyline?
Yes, KEHONG BIO provides custom synthesis services for 6-Iodoclorgyline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.