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Methyl (3-{[(2-iodophenyl)carbonyl]amino}phenoxy)acetate
TL;DR: Methyl (3-{[(2-iodophenyl)carbonyl]amino}phenoxy)acetate (CAS 518009-35-3) is a chemical compound with molecular formula C16H14INO4 and molecular weight 411.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[3-[(2-iodobenzoyl)amino]phenoxy]acetate
Also Known As: CBKinase1_004653, CBKinase1_017053, methyl 2-(3-(2-iodobenzamido)phenoxy)acetate, methyl 2-[3-[(2-iodobenzoyl)amino]phenoxy]acetate, BRD-K05567156-001-01-8
| Molecular Formula | C16H14INO4 |
|---|---|
| Molecular Weight | 411.00 g/mol |
| LogP | 3.0953 |
| Topological Polar Surface Area | 64.63 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 410.99677 |
| Heavy Atoms | 22 |
| Complexity | 687.35095 |
Chemical Identifiers
| CAS Number | 518009-35-3 |
|---|---|
| SMILES | COC(=O)COC1=CC=CC(=C1)NC(=O)C2=CC=CC=C2I |
Product Overview
Methyl (3-{[(2-iodophenyl)carbonyl]amino}phenoxy)acetate (CAS 518009-35-3), with molecular formula C16H14INO4 and molecular weight 411.00 g/mol. IUPAC: methyl 2-[3-[(2-iodobenzoyl)amino]phenoxy]acetate.
Chemical Property Profile of Methyl (3-{[(2-iodophenyl)carbonyl]amino}phenoxy)acetate
Property Insights of Methyl (3-{[(2-iodophenyl)carbonyl]amino}phenoxy)acetate
The XLogP value of 3.0953 indicates that Methyl (3-{[(2-iodophenyl)carbonyl]amino}phenoxy)acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.63 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl (3-{[(2-iodophenyl)carbonyl]amino}phenoxy)acetate. Following Lipinski's Rule of Five, Methyl (3-{[(2-iodophenyl)carbonyl]amino}phenoxy)acetate has 1 hydrogen bond donor(s) and 4 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 Methyl (3-{[(2-iodophenyl)carbonyl]amino}phenoxy)acetate?
The CAS number of Methyl (3-{[(2-iodophenyl)carbonyl]amino}phenoxy)acetate is 518009-35-3.
What is the molecular formula of Methyl (3-{[(2-iodophenyl)carbonyl]amino}phenoxy)acetate?
The molecular formula of Methyl (3-{[(2-iodophenyl)carbonyl]amino}phenoxy)acetate is C16H14INO4.
What is the molecular weight of Methyl (3-{[(2-iodophenyl)carbonyl]amino}phenoxy)acetate?
The molecular weight of Methyl (3-{[(2-iodophenyl)carbonyl]amino}phenoxy)acetate is 411.00 g/mol.
Where can I buy Methyl (3-{[(2-iodophenyl)carbonyl]amino}phenoxy)acetate?
You can request a quote for Methyl (3-{[(2-iodophenyl)carbonyl]amino}phenoxy)acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl (3-{[(2-iodophenyl)carbonyl]amino}phenoxy)acetate?
Yes, KEHONG BIO provides custom synthesis services for Methyl (3-{[(2-iodophenyl)carbonyl]amino}phenoxy)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.