3-[(5,7-diiodoquinolin-8-yl)oxymethyl]-4-ethyl-1H-1,2,4-tria
TL;DR: 3-[(5,7-diiodoquinolin-8-yl)oxymethyl]-4-ethyl-1H-1,2,4-tria (CAS 73511-63-4) is a chemical compound with molecular formula C14H12I2N4OS and molecular weight 537.88 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(5,7-diiodoquinolin-8-yl)oxymethyl]-4-ethyl-1H-1,2,4-triazole-5-thione
Also Known As: 3-[(5,7-diiodoquinolin-8-yl)oxymethyl]-4-ethyl-1H-1,2,4-tria, 5-{[(5,7-Diiodoquinolin-8-yl)oxy]methyl}-4-ethyl-2,4-dihydro-3H-1,2,4-triazole-3-thione, 3-[(5,7-diiodoquinolin-8-yl)oxymethyl]-4-ethyl-1H-1,2,4-triazole-5-thione
| Molecular Formula | C14H12I2N4OS |
|---|---|
| Molecular Weight | 537.88 g/mol |
| LogP | 4.29699 |
| Topological Polar Surface Area | 55.73 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 537.88214 |
| Heavy Atoms | 22 |
| Complexity | 890.1705 |
Chemical Identifiers
| CAS Number | 73511-63-4 |
|---|---|
| SMILES | CCN1C(=NNC1=S)COC2=C(C=C(C3=C2N=CC=C3)I)I |
Product Overview
3-[(5,7-diiodoquinolin-8-yl)oxymethyl]-4-ethyl-1H-1,2,4-tria (CAS 73511-63-4), with molecular formula C14H12I2N4OS and molecular weight 537.88 g/mol. IUPAC: 3-[(5,7-diiodoquinolin-8-yl)oxymethyl]-4-ethyl-1H-1,2,4-triazole-5-thione.
Chemical Property Profile of 3-[(5,7-diiodoquinolin-8-yl)oxymethyl]-4-ethyl-1H-1,2,4-tria
Property Insights of 3-[(5,7-diiodoquinolin-8-yl)oxymethyl]-4-ethyl-1H-1,2,4-tria
The XLogP value of 4.29699 indicates that 3-[(5,7-diiodoquinolin-8-yl)oxymethyl]-4-ethyl-1H-1,2,4-tria is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.73 Ų, 3-[(5,7-diiodoquinolin-8-yl)oxymethyl]-4-ethyl-1H-1,2,4-tria exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-[(5,7-diiodoquinolin-8-yl)oxymethyl]-4-ethyl-1H-1,2,4-tria has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-[(5,7-diiodoquinolin-8-yl)oxymethyl]-4-ethyl-1H-1,2,4-tria?
The CAS number of 3-[(5,7-diiodoquinolin-8-yl)oxymethyl]-4-ethyl-1H-1,2,4-tria is 73511-63-4.
What is the molecular formula of 3-[(5,7-diiodoquinolin-8-yl)oxymethyl]-4-ethyl-1H-1,2,4-tria?
The molecular formula of 3-[(5,7-diiodoquinolin-8-yl)oxymethyl]-4-ethyl-1H-1,2,4-tria is C14H12I2N4OS.
What is the molecular weight of 3-[(5,7-diiodoquinolin-8-yl)oxymethyl]-4-ethyl-1H-1,2,4-tria?
The molecular weight of 3-[(5,7-diiodoquinolin-8-yl)oxymethyl]-4-ethyl-1H-1,2,4-tria is 537.88 g/mol.
Where can I buy 3-[(5,7-diiodoquinolin-8-yl)oxymethyl]-4-ethyl-1H-1,2,4-tria?
You can request a quote for 3-[(5,7-diiodoquinolin-8-yl)oxymethyl]-4-ethyl-1H-1,2,4-tria directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[(5,7-diiodoquinolin-8-yl)oxymethyl]-4-ethyl-1H-1,2,4-tria?
Yes, KEHONG BIO provides custom synthesis services for 3-[(5,7-diiodoquinolin-8-yl)oxymethyl]-4-ethyl-1H-1,2,4-tria and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.