Ethyl 2-benzamido-2-(3,4-dimethoxyphenethylamino)-3,3,3-trifluoropropionate
TL;DR: Ethyl 2-benzamido-2-(3,4-dimethoxyphenethylamino)-3,3,3-trifluoropropionate (CAS 372175-46-7) is a chemical compound with molecular formula C22H25F3N2O5 and molecular weight 454.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-benzamido-2-[2-(3,4-dimethoxyphenyl)ethylamino]-3,3,3-trifluoropropanoate
Also Known As: Ethyl 2-benzamido-2-(3,4-dimethoxyphenethylamino)-3,3,3-trifluoropropionate, ethyl 2-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-3,3,3-trifluoro-N-(phenylcarbonyl)alaninate, ethyl 2-benzamido-2-((3,4-dimethoxyphenethyl)amino)-3,3,3-trifluoropropanoate, ethyl 2-benzamido-2-[2-(3,4-dimethoxyphenyl)ethylamino]-3,3,3-trifluoropropanoate, Ethyl 2-(benzoylamino)-2-([2-(3,4-dimethoxyphenyl)ethyl]amino)-3,3,3-trifluoropropanoate #
| Molecular Formula | C22H25F3N2O5 |
|---|---|
| Molecular Weight | 454.17 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 85.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 11 |
| Exact Mass | 454.17157 |
| Heavy Atoms | 32 |
| Complexity | 613.0 |
Chemical Identifiers
| CAS Number | 372175-46-7 |
|---|---|
| SMILES | CCOC(=O)C(C(F)(F)F)(NCCC1=CC(=C(C=C1)OC)OC)NC(=O)C2=CC=CC=C2 |
| InChIKey | FITVIAMYOUOOGJ-UHFFFAOYSA-N |
Product Overview
Ethyl 2-benzamido-2-(3,4-dimethoxyphenethylamino)-3,3,3-trifluoropropionate (CAS 372175-46-7), with molecular formula C22H25F3N2O5 and molecular weight 454.17 g/mol. IUPAC: ethyl 2-benzamido-2-[2-(3,4-dimethoxyphenyl)ethylamino]-3,3,3-trifluoropropanoate.
Chemical Property Profile of Ethyl 2-benzamido-2-(3,4-dimethoxyphenethylamino)-3,3,3-trifluoropropionate
Property Insights of Ethyl 2-benzamido-2-(3,4-dimethoxyphenethylamino)-3,3,3-trifluoropropionate
The XLogP value of 4.0 indicates that Ethyl 2-benzamido-2-(3,4-dimethoxyphenethylamino)-3,3,3-trifluoropropionate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 2-benzamido-2-(3,4-dimethoxyphenethylamino)-3,3,3-trifluoropropionate. Following Lipinski's Rule of Five, Ethyl 2-benzamido-2-(3,4-dimethoxyphenethylamino)-3,3,3-trifluoropropionate has 2 hydrogen bond donor(s) and 9 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 Ethyl 2-benzamido-2-(3,4-dimethoxyphenethylamino)-3,3,3-trifluoropropionate?
The CAS number of Ethyl 2-benzamido-2-(3,4-dimethoxyphenethylamino)-3,3,3-trifluoropropionate is 372175-46-7.
What is the molecular formula of Ethyl 2-benzamido-2-(3,4-dimethoxyphenethylamino)-3,3,3-trifluoropropionate?
The molecular formula of Ethyl 2-benzamido-2-(3,4-dimethoxyphenethylamino)-3,3,3-trifluoropropionate is C22H25F3N2O5.
What is the molecular weight of Ethyl 2-benzamido-2-(3,4-dimethoxyphenethylamino)-3,3,3-trifluoropropionate?
The molecular weight of Ethyl 2-benzamido-2-(3,4-dimethoxyphenethylamino)-3,3,3-trifluoropropionate is 454.17 g/mol.
Where can I buy Ethyl 2-benzamido-2-(3,4-dimethoxyphenethylamino)-3,3,3-trifluoropropionate?
You can request a quote for Ethyl 2-benzamido-2-(3,4-dimethoxyphenethylamino)-3,3,3-trifluoropropionate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2-benzamido-2-(3,4-dimethoxyphenethylamino)-3,3,3-trifluoropropionate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-benzamido-2-(3,4-dimethoxyphenethylamino)-3,3,3-trifluoropropionate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.