![methyl 3,3,3-trifluoro-N-[(2-fluorophenyl)carbamoyl]-2-phenoxyalaninate structure](/static/products/355/355146-27-9.png)
methyl 3,3,3-trifluoro-N-[(2-fluorophenyl)carbamoyl]-2-phenoxyalaninate
TL;DR: methyl 3,3,3-trifluoro-N-[(2-fluorophenyl)carbamoyl]-2-phenoxyalaninate (CAS 355146-27-9) is a chemical compound with molecular formula C17H14F4N2O4 and molecular weight 386.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3,3,3-trifluoro-2-[(2-fluorophenyl)carbamoylamino]-2-phenoxypropanoate
Also Known As: methyl 3,3,3-trifluoro-2-(3-(2-fluorophenyl)ureido)-2-phenoxypropanoate, methyl 3,3,3-trifluoro-N-[(2-fluorophenyl)carbamoyl]-2-phenoxyalaninate, methyl 3,3,3-trifluoro-2-[(2-fluorophenyl)carbamoylamino]-2-phenoxypropanoate
| Molecular Formula | C17H14F4N2O4 |
|---|---|
| Molecular Weight | 386.09 g/mol |
| LogP | 3.4578 |
| Topological Polar Surface Area | 76.66 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 386.08896 |
| Heavy Atoms | 27 |
| Complexity | 814.08075 |
Chemical Identifiers
| CAS Number | 355146-27-9 |
|---|---|
| SMILES | COC(=O)C(C(F)(F)F)(NC(=O)NC1=CC=CC=C1F)OC2=CC=CC=C2 |
Product Overview
methyl 3,3,3-trifluoro-N-[(2-fluorophenyl)carbamoyl]-2-phenoxyalaninate (CAS 355146-27-9), with molecular formula C17H14F4N2O4 and molecular weight 386.09 g/mol. IUPAC: methyl 3,3,3-trifluoro-2-[(2-fluorophenyl)carbamoylamino]-2-phenoxypropanoate.
Chemical Property Profile of methyl 3,3,3-trifluoro-N-[(2-fluorophenyl)carbamoyl]-2-phenoxyalaninate
Property Insights of methyl 3,3,3-trifluoro-N-[(2-fluorophenyl)carbamoyl]-2-phenoxyalaninate
The XLogP value of 3.4578 indicates that methyl 3,3,3-trifluoro-N-[(2-fluorophenyl)carbamoyl]-2-phenoxyalaninate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.66 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl 3,3,3-trifluoro-N-[(2-fluorophenyl)carbamoyl]-2-phenoxyalaninate. Following Lipinski's Rule of Five, methyl 3,3,3-trifluoro-N-[(2-fluorophenyl)carbamoyl]-2-phenoxyalaninate has 2 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 3,3,3-trifluoro-N-[(2-fluorophenyl)carbamoyl]-2-phenoxyalaninate?
The CAS number of methyl 3,3,3-trifluoro-N-[(2-fluorophenyl)carbamoyl]-2-phenoxyalaninate is 355146-27-9.
What is the molecular formula of methyl 3,3,3-trifluoro-N-[(2-fluorophenyl)carbamoyl]-2-phenoxyalaninate?
The molecular formula of methyl 3,3,3-trifluoro-N-[(2-fluorophenyl)carbamoyl]-2-phenoxyalaninate is C17H14F4N2O4.
What is the molecular weight of methyl 3,3,3-trifluoro-N-[(2-fluorophenyl)carbamoyl]-2-phenoxyalaninate?
The molecular weight of methyl 3,3,3-trifluoro-N-[(2-fluorophenyl)carbamoyl]-2-phenoxyalaninate is 386.09 g/mol.
Where can I buy methyl 3,3,3-trifluoro-N-[(2-fluorophenyl)carbamoyl]-2-phenoxyalaninate?
You can request a quote for methyl 3,3,3-trifluoro-N-[(2-fluorophenyl)carbamoyl]-2-phenoxyalaninate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl 3,3,3-trifluoro-N-[(2-fluorophenyl)carbamoyl]-2-phenoxyalaninate?
Yes, KEHONG BIO provides custom synthesis services for methyl 3,3,3-trifluoro-N-[(2-fluorophenyl)carbamoyl]-2-phenoxyalaninate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.