TL;DR: (1-Ethylpyrrolidin-3-yl) 2-ethoxy-2,2-diphenylacetate (CAS 744133-62-8) is a chemical compound with molecular formula C22H27NO3 and molecular weight 353.1991 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(1-ethylpyrrolidin-3-yl) 2-ethoxy-2,2-diphenylacetate
Also Known As: 1-ethylpyrrolidin-3-yl ethoxy(diphenyl)acetate, (1-ethylpyrrolidin-3-yl) 2-ethoxy-2,2-diphenylacetate, (1-ethylpyrrolidin-3-yl) 2-ethoxy-2,2-diphenyl-acetate
| Molecular Formula | C22H27NO3 |
| Molecular Weight | 353.1991 g/mol |
| XLogP | 4.1 |
| Topological Polar Surface Area (TPSA) | 38.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 353.1991 Da |
| Heavy Atoms | 26 |
| Complexity | 423.0 |
| SMILES | CCN1CCC(C1)OC(=O)C(C2=CC=CC=C2)(C3=CC=CC=C3)OCC |
| InChIKey | KQWLKNQCUOBOFE-UHFFFAOYSA-N |
The XLogP value of 4.1 indicates that (1-Ethylpyrrolidin-3-yl) 2-ethoxy-2,2-diphenylacetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.8 Ų, (1-Ethylpyrrolidin-3-yl) 2-ethoxy-2,2-diphenylacetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (1-Ethylpyrrolidin-3-yl) 2-ethoxy-2,2-diphenylacetate has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of (1-Ethylpyrrolidin-3-yl) 2-ethoxy-2,2-diphenylacetate is 744133-62-8.
The molecular formula of (1-Ethylpyrrolidin-3-yl) 2-ethoxy-2,2-diphenylacetate is C22H27NO3.
The molecular weight of (1-Ethylpyrrolidin-3-yl) 2-ethoxy-2,2-diphenylacetate is 353.1991 g/mol.
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