TL;DR: (S)-4-methoxy-3-((2-(pyridin-3-yl)piperidin-1-yl)methyl)benzaldehyde (CAS 1217615-60-5) is a chemical compound with molecular formula C19H22N2O2 and molecular weight 310.16812 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-methoxy-3-[[(2S)-2-pyridin-3-ylpiperidin-1-yl]methyl]benzaldehyde
Also Known As: (S)-4-methoxy-3-((2-(pyridin-3-yl)piperidin-1-yl)methyl)benzaldehyde, 4-methoxy-3-[[(2S)-2-pyridin-3-ylpiperidin-1-yl]methyl]benzaldehyde, Benzaldehyde, 4-methoxy-3-[2-(3-pyridyl)-1-piperidyl)-
| Molecular Formula | C19H22N2O2 |
| Molecular Weight | 310.16812 g/mol |
| XLogP | 2.5 |
| Topological Polar Surface Area (TPSA) | 42.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 310.16812 Da |
| Heavy Atoms | 23 |
| Complexity | 376.0 |
| SMILES | COC1=C(C=C(C=C1)C=O)CN2CCCC[C@H]2C3=CN=CC=C3 |
| InChIKey | JFLRQHFNVMTJEA-SFHVURJKSA-N |
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (S)-4-methoxy-3-((2-(pyridin-3-yl)piperidin-1-yl)methyl)benzaldehyde. With a topological polar surface area (TPSA) of 42.4 Ų, (S)-4-methoxy-3-((2-(pyridin-3-yl)piperidin-1-yl)methyl)benzaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (S)-4-methoxy-3-((2-(pyridin-3-yl)piperidin-1-yl)methyl)benzaldehyde 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 (S)-4-methoxy-3-((2-(pyridin-3-yl)piperidin-1-yl)methyl)benzaldehyde is 1217615-60-5.
The molecular formula of (S)-4-methoxy-3-((2-(pyridin-3-yl)piperidin-1-yl)methyl)benzaldehyde is C19H22N2O2.
The molecular weight of (S)-4-methoxy-3-((2-(pyridin-3-yl)piperidin-1-yl)methyl)benzaldehyde is 310.16812 g/mol.
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