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Methyl 2-{[(2-fluorophenyl)carbamoyl]amino}-4,5-dimethoxybenzoate
TL;DR: Methyl 2-{[(2-fluorophenyl)carbamoyl]amino}-4,5-dimethoxybenzoate (CAS 522660-28-2) is a chemical compound with molecular formula C17H17FN2O5 and molecular weight 348.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[(2-fluorophenyl)carbamoylamino]-4,5-dimethoxybenzoate
Also Known As: methyl 2-{[(2-fluorophenyl)carbamoyl]amino}-4,5-dimethoxybenzoate, methyl 2-(3-(2-fluorophenyl)ureido)-4,5-dimethoxybenzoate, methyl 2-[(2-fluorophenyl)carbamoylamino]-4,5-dimethoxybenzoate, 2-[3-(2-Fluoro-phenyl)-ureido]-4,5-dimethoxy-benzoic acid methyl ester, methyl 2-{[(2-fluorophenyl)amino]carbonylamino}-4,5-dimethoxybenzoate
| Molecular Formula | C17H17FN2O5 |
|---|---|
| Molecular Weight | 348.11 g/mol |
| LogP | 3.2735 |
| Topological Polar Surface Area | 85.89 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 348.11215 |
| Heavy Atoms | 25 |
| Complexity | 794.60284 |
Chemical Identifiers
| CAS Number | 522660-28-2 |
|---|---|
| SMILES | COC1=C(C=C(C(=C1)C(=O)OC)NC(=O)NC2=CC=CC=C2F)OC |
Product Overview
Methyl 2-{[(2-fluorophenyl)carbamoyl]amino}-4,5-dimethoxybenzoate (CAS 522660-28-2), with molecular formula C17H17FN2O5 and molecular weight 348.11 g/mol. IUPAC: methyl 2-[(2-fluorophenyl)carbamoylamino]-4,5-dimethoxybenzoate.
Chemical Property Profile of Methyl 2-{[(2-fluorophenyl)carbamoyl]amino}-4,5-dimethoxybenzoate
Property Insights of Methyl 2-{[(2-fluorophenyl)carbamoyl]amino}-4,5-dimethoxybenzoate
The XLogP value of 3.2735 indicates that Methyl 2-{[(2-fluorophenyl)carbamoyl]amino}-4,5-dimethoxybenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.89 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 2-{[(2-fluorophenyl)carbamoyl]amino}-4,5-dimethoxybenzoate. Following Lipinski's Rule of Five, Methyl 2-{[(2-fluorophenyl)carbamoyl]amino}-4,5-dimethoxybenzoate has 2 hydrogen bond donor(s) and 5 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 2-{[(2-fluorophenyl)carbamoyl]amino}-4,5-dimethoxybenzoate?
The CAS number of Methyl 2-{[(2-fluorophenyl)carbamoyl]amino}-4,5-dimethoxybenzoate is 522660-28-2.
What is the molecular formula of Methyl 2-{[(2-fluorophenyl)carbamoyl]amino}-4,5-dimethoxybenzoate?
The molecular formula of Methyl 2-{[(2-fluorophenyl)carbamoyl]amino}-4,5-dimethoxybenzoate is C17H17FN2O5.
What is the molecular weight of Methyl 2-{[(2-fluorophenyl)carbamoyl]amino}-4,5-dimethoxybenzoate?
The molecular weight of Methyl 2-{[(2-fluorophenyl)carbamoyl]amino}-4,5-dimethoxybenzoate is 348.11 g/mol.
Where can I buy Methyl 2-{[(2-fluorophenyl)carbamoyl]amino}-4,5-dimethoxybenzoate?
You can request a quote for Methyl 2-{[(2-fluorophenyl)carbamoyl]amino}-4,5-dimethoxybenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2-{[(2-fluorophenyl)carbamoyl]amino}-4,5-dimethoxybenzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-{[(2-fluorophenyl)carbamoyl]amino}-4,5-dimethoxybenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.