![[(2-Phenylethyl)carbamoyl]methyl 4-fluorobenzoate structure](/static/products/861/861238-07-5.png)
[(2-Phenylethyl)carbamoyl]methyl 4-fluorobenzoate
TL;DR: [(2-Phenylethyl)carbamoyl]methyl 4-fluorobenzoate (CAS 861238-07-5) is a chemical compound with molecular formula C17H16FNO3 and molecular weight 301.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-oxo-2-(2-phenylethylamino)ethyl] 4-fluorobenzoate
Also Known As: [(2-phenylethyl)carbamoyl]methyl 4-fluorobenzoate|2-oxo-2-(phenethylamino)ethyl 4-fluorobenzoate|[2-oxo-2-(phenethylamino)ethyl] 4-fluorobenzoate|[2-oxo-2-(2-phenylethylamino)ethyl] 4-fluorobenzoate|F6609-4220
| Molecular Formula | C17H16FNO3 |
|---|---|
| Molecular Weight | 301.11 g/mol |
| LogP | 2.3414 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 301.11142 |
| Heavy Atoms | 22 |
| Complexity | 626.1121 |
Chemical Identifiers
| CAS Number | 861238-07-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)CCNC(=O)COC(=O)C2=CC=C(C=C2)F |
Product Overview
[(2-Phenylethyl)carbamoyl]methyl 4-fluorobenzoate (CAS 861238-07-5), with molecular formula C17H16FNO3 and molecular weight 301.11 g/mol. IUPAC: [2-oxo-2-(2-phenylethylamino)ethyl] 4-fluorobenzoate.
Chemical Property Profile of [(2-Phenylethyl)carbamoyl]methyl 4-fluorobenzoate
Property Insights of [(2-Phenylethyl)carbamoyl]methyl 4-fluorobenzoate
The XLogP value of 2.3414 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [(2-Phenylethyl)carbamoyl]methyl 4-fluorobenzoate. With a topological polar surface area (TPSA) of 55.4 Ų, [(2-Phenylethyl)carbamoyl]methyl 4-fluorobenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [(2-Phenylethyl)carbamoyl]methyl 4-fluorobenzoate has 1 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 [(2-Phenylethyl)carbamoyl]methyl 4-fluorobenzoate?
The CAS number of [(2-Phenylethyl)carbamoyl]methyl 4-fluorobenzoate is 861238-07-5.
What is the molecular formula of [(2-Phenylethyl)carbamoyl]methyl 4-fluorobenzoate?
The molecular formula of [(2-Phenylethyl)carbamoyl]methyl 4-fluorobenzoate is C17H16FNO3.
What is the molecular weight of [(2-Phenylethyl)carbamoyl]methyl 4-fluorobenzoate?
The molecular weight of [(2-Phenylethyl)carbamoyl]methyl 4-fluorobenzoate is 301.11 g/mol.
Where can I buy [(2-Phenylethyl)carbamoyl]methyl 4-fluorobenzoate?
You can request a quote for [(2-Phenylethyl)carbamoyl]methyl 4-fluorobenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [(2-Phenylethyl)carbamoyl]methyl 4-fluorobenzoate?
Yes, KEHONG BIO provides custom synthesis services for [(2-Phenylethyl)carbamoyl]methyl 4-fluorobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.