TL;DR: RefChem:340873 (CAS 73927-36-3) is a chemical compound with molecular formula C20H21ClF3NO3 and molecular weight 415.1162 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[1-[3-(trifluoromethyl)phenyl]propan-2-ylamino]ethyl 2-(4-chlorophenoxy)acetate
Also Known As: N-(2-Hydroxyethyl)-alpha-methyl-m-trifluoromethylphenethylamine p-chlorophenoxyacetate, 2-(alpha-Methyl-m-trifluoromethylphenethylamino)ethanol p-chlorophenoxyacetate, Ethanol, 2-(alpha-methyl-m-trifluoromethylphenethylamino)-, p-chlorophenoxyacetate, Phenethylamine, N-(2-hydroxyethyl)-alpha-methyl-m-trifluoromethyl-, p-chlorophenoxyacetate, 2-({1-[3-(trifluoromethyl)phenyl]propan-2-yl}amino)ethyl (4-chlorophenoxy)acetate
| Molecular Formula | C20H21ClF3NO3 |
| Molecular Weight | 415.1162 g/mol |
| XLogP | 5.3 |
| Topological Polar Surface Area (TPSA) | 47.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 10 |
| Exact Mass | 415.1162 Da |
| Heavy Atoms | 28 |
| Complexity | 470.0 |
| SMILES | CC(CC1=CC(=CC=C1)C(F)(F)F)NCCOC(=O)COC2=CC=C(C=C2)Cl |
| InChIKey | LCDHGYNHIIYKRE-UHFFFAOYSA-N |
The XLogP value of 5.3 indicates that RefChem:340873 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.6 Ų, RefChem:340873 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:340873 has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of RefChem:340873 is 73927-36-3.
The molecular formula of RefChem:340873 is C20H21ClF3NO3.
The molecular weight of RefChem:340873 is 415.1162 g/mol.
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