TL;DR: (3R)-1-{2-[tris(4-methoxyphenyl)methoxy]ethyl}piperidine-3-carboxylic acid (CAS 157604-55-2) is a chemical compound with molecular formula C30H35NO6 and molecular weight 505.24643 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3R)-1-[2-[tris(4-methoxyphenyl)methoxy]ethyl]piperidine-3-carboxylic acid
Also Known As: (S)-SNAP 5114, (3R)-1-{2-[tris(4-methoxyphenyl)methoxy]ethyl}piperidine-3-carboxylic acid, (R)-1-(2-(Tris(4-methoxyphenyl)methoxy)ethyl)piperidine-3-carboxylic acid, (3R)-1-[2-[tris(4-methoxyphenyl)methoxy]ethyl]piperidine-3-carboxylic acid, (3R)-1-[2-[(4,4 ,4 -Trimethoxytrityl)oxy]ethyl]piperidine-3-carboxylic acid
| Molecular Formula | C30H35NO6 |
| Molecular Weight | 505.24643 g/mol |
| XLogP | 2.4 |
| Topological Polar Surface Area (TPSA) | 77.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 11 |
| Exact Mass | 505.24643 Da |
| Heavy Atoms | 37 |
| Complexity | 620.0 |
| SMILES | COC1=CC=C(C=C1)C(C2=CC=C(C=C2)OC)(C3=CC=C(C=C3)OC)OCCN4CCC[C@H](C4)C(=O)O |
| InChIKey | VDLDUZLDZBVOAS-JOCHJYFZSA-N |
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (3R)-1-{2-[tris(4-methoxyphenyl)methoxy]ethyl}piperidine-3-carboxylic acid. The TPSA of 77.5 Ų falls within the moderate polarity range, balancing permeability and solubility for (3R)-1-{2-[tris(4-methoxyphenyl)methoxy]ethyl}piperidine-3-carboxylic acid. Following Lipinski's Rule of Five, (3R)-1-{2-[tris(4-methoxyphenyl)methoxy]ethyl}piperidine-3-carboxylic acid has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of (3R)-1-{2-[tris(4-methoxyphenyl)methoxy]ethyl}piperidine-3-carboxylic acid is 157604-55-2.
The molecular formula of (3R)-1-{2-[tris(4-methoxyphenyl)methoxy]ethyl}piperidine-3-carboxylic acid is C30H35NO6.
The molecular weight of (3R)-1-{2-[tris(4-methoxyphenyl)methoxy]ethyl}piperidine-3-carboxylic acid is 505.24643 g/mol.
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