TL;DR: 2-Oxaspiro(4.4)nonane-3-acetic acid, 1-oxo-1-phenyl-, 1-methyl-4-piperidyl ester (CAS 101834-43-9) is a chemical compound with molecular formula C22H29NO4 and molecular weight 371.20966 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(1-methylpiperidin-4-yl) 2-(1-oxo-3-phenyl-2-oxaspiro[4.4]nonan-3-yl)acetate
Also Known As: 2-OXASPIRO(4.4)NONANE-3-ACETIC ACID, 1-OXO-1-PHENYL-, 1-METHYL-4-PIPERIDYL ESTER, 1-Methyl-4-piperidyl-1-(1-carboxycyclopentyl)-3-hydroxy-3-phenylbutyrate gamma-lactone, 1-Methylpiperidin-4-yl (1-oxo-3-phenyl-2-oxaspiro[4.4]nonan-3-yl)acetate, 1-methylpiperidin-4-yl(1-oxo-3-phenyl-2-oxaspiro[4.4]non-3-yl)acetate, (1-methylpiperidin-4-yl) 2-(9-oxo-7-phenyl-8-oxaspiro[4.4]nonan-7-yl)acetate
| Molecular Formula | C22H29NO4 |
| Molecular Weight | 371.20966 g/mol |
| XLogP | 3.4 |
| Topological Polar Surface Area (TPSA) | 55.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 371.20966 Da |
| Heavy Atoms | 27 |
| Complexity | 557.0 |
| SMILES | CN1CCC(CC1)OC(=O)CC2(CC3(CCCC3)C(=O)O2)C4=CC=CC=C4 |
| InChIKey | HSLUGXGVPLWRMZ-UHFFFAOYSA-N |
The XLogP value of 3.4 indicates that 2-Oxaspiro(4.4)nonane-3-acetic acid, 1-oxo-1-phenyl-, 1-methyl-4-piperidyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.8 Ų, 2-Oxaspiro(4.4)nonane-3-acetic acid, 1-oxo-1-phenyl-, 1-methyl-4-piperidyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Oxaspiro(4.4)nonane-3-acetic acid, 1-oxo-1-phenyl-, 1-methyl-4-piperidyl ester has 0 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 2-Oxaspiro(4.4)nonane-3-acetic acid, 1-oxo-1-phenyl-, 1-methyl-4-piperidyl ester is 101834-43-9.
The molecular formula of 2-Oxaspiro(4.4)nonane-3-acetic acid, 1-oxo-1-phenyl-, 1-methyl-4-piperidyl ester is C22H29NO4.
The molecular weight of 2-Oxaspiro(4.4)nonane-3-acetic acid, 1-oxo-1-phenyl-, 1-methyl-4-piperidyl ester is 371.20966 g/mol.
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