TL;DR: 1-Methylpiperidin-4-yl 2-(4-(tert-butyl)phenoxy)acetate hydrochloride (CAS 1052524-31-8) is a chemical compound with molecular formula C18H28ClNO3 and molecular weight 341.17578 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(1-methylpiperidin-4-yl) 2-(4-tert-butylphenoxy)acetate;hydrochloride
Also Known As: 1-methylpiperidin-4-yl 2-(4-(tert-butyl)phenoxy)acetate hydrochloride, (1-methylpiperidin-4-yl) 2-(4-tert-butylphenoxy)acetate hydrochloride
| Molecular Formula | C18H28ClNO3 |
| Molecular Weight | 341.17578 g/mol |
| XLogP | 3.4221 |
| Topological Polar Surface Area (TPSA) | 38.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 341.17578 Da |
| Heavy Atoms | 23 |
| Complexity | 348.0 |
| SMILES | CC(C)(C)C1=CC=C(C=C1)OCC(=O)OC2CCN(CC2)C.Cl |
| InChIKey | WKVWOBYIBRTIAS-UHFFFAOYSA-N |
The XLogP value of 3.4221 indicates that 1-Methylpiperidin-4-yl 2-(4-(tert-butyl)phenoxy)acetate hydrochloride 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-Methylpiperidin-4-yl 2-(4-(tert-butyl)phenoxy)acetate hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Methylpiperidin-4-yl 2-(4-(tert-butyl)phenoxy)acetate hydrochloride has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 1-Methylpiperidin-4-yl 2-(4-(tert-butyl)phenoxy)acetate hydrochloride is 1052524-31-8.
The molecular formula of 1-Methylpiperidin-4-yl 2-(4-(tert-butyl)phenoxy)acetate hydrochloride is C18H28ClNO3.
The molecular weight of 1-Methylpiperidin-4-yl 2-(4-(tert-butyl)phenoxy)acetate hydrochloride is 341.17578 g/mol.
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