TL;DR: Ketone, 5-benzyloxy-3-indolyl 4-piperidyl (CAS 101670-78-4) is a chemical compound with molecular formula C21H22N2O2 and molecular weight 334.16812 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(5-phenylmethoxy-1H-indol-3-yl)-piperidin-4-ylmethanone
Also Known As: 5-Benzyloxy-3-isonipecotoylindole, Indole, 5-benzyloxy-3-isonipecotoyl-, KETONE, 5-BENZYLOXY-3-INDOLYL 4-PIPERIDYL, Indole,5-benzyloxy-3-isonipecotoyl, 4-Piperidyl 5-benzyloxy-1H-indol-3-yl ketone
| Molecular Formula | C21H22N2O2 |
| Molecular Weight | 334.16812 g/mol |
| XLogP | 3.2 |
| Topological Polar Surface Area (TPSA) | 54.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 334.16812 Da |
| Heavy Atoms | 25 |
| Complexity | 443.0 |
| SMILES | C1CNCCC1C(=O)C2=CNC3=C2C=C(C=C3)OCC4=CC=CC=C4 |
| InChIKey | IMVYEAYZQOEKCO-UHFFFAOYSA-N |
The XLogP value of 3.2 indicates that Ketone, 5-benzyloxy-3-indolyl 4-piperidyl is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.1 Ų, Ketone, 5-benzyloxy-3-indolyl 4-piperidyl exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ketone, 5-benzyloxy-3-indolyl 4-piperidyl has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Ketone, 5-benzyloxy-3-indolyl 4-piperidyl is 101670-78-4.
The molecular formula of Ketone, 5-benzyloxy-3-indolyl 4-piperidyl is C21H22N2O2.
The molecular weight of Ketone, 5-benzyloxy-3-indolyl 4-piperidyl is 334.16812 g/mol.
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