![Methyl 3-{[(4-fluorophenyl)carbamoyl]amino}benzoate structure](/static/products/861/861444-41-9.png)
Methyl 3-{[(4-fluorophenyl)carbamoyl]amino}benzoate
TL;DR: Methyl 3-{[(4-fluorophenyl)carbamoyl]amino}benzoate (CAS 861444-41-9) is a chemical compound with molecular formula C15H13FN2O3 and molecular weight 288.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-[(4-fluorophenyl)carbamoylamino]benzoate
Also Known As: Methyl 3-[(4-fluorophenyl)carbamoylamino]benzoate, methyl 3-{[(4-fluorophenyl)carbamoyl]amino}benzoate, methyl 3-({[(4-fluorophenyl)amino]carbonyl}amino)benzoate, METHYL 3-{[(4-FLUOROANILINO)CARBONYL]AMINO}BENZOATE
| Molecular Formula | C15H13FN2O3 |
|---|---|
| Molecular Weight | 288.09 g/mol |
| LogP | 3.2563 |
| Topological Polar Surface Area | 67.43 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 288.09103 |
| Heavy Atoms | 21 |
| Complexity | 656.2232 |
Chemical Identifiers
| CAS Number | 861444-41-9 |
|---|---|
| SMILES | COC(=O)C1=CC(=CC=C1)NC(=O)NC2=CC=C(C=C2)F |
Product Overview
Methyl 3-{[(4-fluorophenyl)carbamoyl]amino}benzoate (CAS 861444-41-9), with molecular formula C15H13FN2O3 and molecular weight 288.09 g/mol. IUPAC: methyl 3-[(4-fluorophenyl)carbamoylamino]benzoate.
Chemical Property Profile of Methyl 3-{[(4-fluorophenyl)carbamoyl]amino}benzoate
Property Insights of Methyl 3-{[(4-fluorophenyl)carbamoyl]amino}benzoate
The XLogP value of 3.2563 indicates that Methyl 3-{[(4-fluorophenyl)carbamoyl]amino}benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.43 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 3-{[(4-fluorophenyl)carbamoyl]amino}benzoate. Following Lipinski's Rule of Five, Methyl 3-{[(4-fluorophenyl)carbamoyl]amino}benzoate has 2 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 Methyl 3-{[(4-fluorophenyl)carbamoyl]amino}benzoate?
The CAS number of Methyl 3-{[(4-fluorophenyl)carbamoyl]amino}benzoate is 861444-41-9.
What is the molecular formula of Methyl 3-{[(4-fluorophenyl)carbamoyl]amino}benzoate?
The molecular formula of Methyl 3-{[(4-fluorophenyl)carbamoyl]amino}benzoate is C15H13FN2O3.
What is the molecular weight of Methyl 3-{[(4-fluorophenyl)carbamoyl]amino}benzoate?
The molecular weight of Methyl 3-{[(4-fluorophenyl)carbamoyl]amino}benzoate is 288.09 g/mol.
Where can I buy Methyl 3-{[(4-fluorophenyl)carbamoyl]amino}benzoate?
You can request a quote for Methyl 3-{[(4-fluorophenyl)carbamoyl]amino}benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 3-{[(4-fluorophenyl)carbamoyl]amino}benzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 3-{[(4-fluorophenyl)carbamoyl]amino}benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.