TL;DR: Phenol, 3-(3-ethyl-1-propyl-3-piperidinyl)-, hydrobromide (CAS 126088-59-3) is a chemical compound with molecular formula C16H26BrNO and molecular weight 327.11978 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(3-ethyl-1-propylpiperidin-3-yl)phenol;hydrobromide
Also Known As: 3-Ethyl-3-(3-hydroxyphenyl)-1-propylpiperidine hydrobromide, Phenol, 3-(3-ethyl-1-propyl-3-piperidinyl)-, hydrobromide, 3-(3-ethyl-1-propylpiperidin-3-yl)phenol hydrobromide, 3-(3-ethyl-1-propylpiperidin-3-yl)phenol,hydrobromide, 3-(3-Ethyl-1-propylpiperidin-3-yl)phenol--hydrogen bromide (1/1)
| Molecular Formula | C16H26BrNO |
| Molecular Weight | 327.11978 g/mol |
| XLogP | 4.1237 |
| Topological Polar Surface Area (TPSA) | 23.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 327.11978 Da |
| Heavy Atoms | 19 |
| Complexity | 255.0 |
| SMILES | CCCN1CCCC(C1)(CC)C2=CC(=CC=C2)O.Br |
| InChIKey | YVQLAHYGZRKCCV-UHFFFAOYSA-N |
The XLogP value of 4.1237 indicates that Phenol, 3-(3-ethyl-1-propyl-3-piperidinyl)-, hydrobromide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 23.5 Ų, Phenol, 3-(3-ethyl-1-propyl-3-piperidinyl)-, hydrobromide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phenol, 3-(3-ethyl-1-propyl-3-piperidinyl)-, hydrobromide has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Phenol, 3-(3-ethyl-1-propyl-3-piperidinyl)-, hydrobromide is 126088-59-3.
The molecular formula of Phenol, 3-(3-ethyl-1-propyl-3-piperidinyl)-, hydrobromide is C16H26BrNO.
The molecular weight of Phenol, 3-(3-ethyl-1-propyl-3-piperidinyl)-, hydrobromide is 327.11978 g/mol.
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