1-(4-Chloropyrazol-1-yl)-2-(4-iodophenoxy)ethanone
TL;DR: 1-(4-Chloropyrazol-1-yl)-2-(4-iodophenoxy)ethanone (CAS 489408-10-8) is a chemical compound with molecular formula C11H8ClIN2O2 and molecular weight 361.93 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-chloropyrazol-1-yl)-2-(4-iodophenoxy)ethanone
Also Known As: 1-(4-chloropyrazol-1-yl)-2-(4-iodophenoxy)ethanone, 4-chloro-1-[(4-iodophenoxy)acetyl]-1H-pyrazole, 1-(4-chloropyrazolyl)-2-(4-iodophenoxy)ethan-1-one, 1-(4-chloro-1H-pyrazol-1-yl)-2-(4-iodophenoxy)ethanone, 1-(4-CHLORO-1H-PYRAZOL-1-YL)-2-(4-IODOPHENOXY)-1-ETHANONE
| Molecular Formula | C11H8ClIN2O2 |
|---|---|
| Molecular Weight | 361.93 g/mol |
| LogP | 2.8603 |
| Topological Polar Surface Area | 44.12 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 361.9319 |
| Heavy Atoms | 17 |
| Complexity | 524.52264 |
Chemical Identifiers
| CAS Number | 489408-10-8 |
|---|---|
| SMILES | C1=CC(=CC=C1OCC(=O)N2C=C(C=N2)Cl)I |
Product Overview
1-(4-Chloropyrazol-1-yl)-2-(4-iodophenoxy)ethanone (CAS 489408-10-8), with molecular formula C11H8ClIN2O2 and molecular weight 361.93 g/mol. IUPAC: 1-(4-chloropyrazol-1-yl)-2-(4-iodophenoxy)ethanone.
Chemical Property Profile of 1-(4-Chloropyrazol-1-yl)-2-(4-iodophenoxy)ethanone
Property Insights of 1-(4-Chloropyrazol-1-yl)-2-(4-iodophenoxy)ethanone
The XLogP value of 2.8603 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-Chloropyrazol-1-yl)-2-(4-iodophenoxy)ethanone. With a topological polar surface area (TPSA) of 44.12 Ų, 1-(4-Chloropyrazol-1-yl)-2-(4-iodophenoxy)ethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-Chloropyrazol-1-yl)-2-(4-iodophenoxy)ethanone has 0 hydrogen bond donor(s) and 3 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 1-(4-Chloropyrazol-1-yl)-2-(4-iodophenoxy)ethanone?
The CAS number of 1-(4-Chloropyrazol-1-yl)-2-(4-iodophenoxy)ethanone is 489408-10-8.
What is the molecular formula of 1-(4-Chloropyrazol-1-yl)-2-(4-iodophenoxy)ethanone?
The molecular formula of 1-(4-Chloropyrazol-1-yl)-2-(4-iodophenoxy)ethanone is C11H8ClIN2O2.
What is the molecular weight of 1-(4-Chloropyrazol-1-yl)-2-(4-iodophenoxy)ethanone?
The molecular weight of 1-(4-Chloropyrazol-1-yl)-2-(4-iodophenoxy)ethanone is 361.93 g/mol.
Where can I buy 1-(4-Chloropyrazol-1-yl)-2-(4-iodophenoxy)ethanone?
You can request a quote for 1-(4-Chloropyrazol-1-yl)-2-(4-iodophenoxy)ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Chloropyrazol-1-yl)-2-(4-iodophenoxy)ethanone?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Chloropyrazol-1-yl)-2-(4-iodophenoxy)ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.