TL;DR: RefChem:1096153 (CAS 139193-88-7) is a chemical compound with molecular formula C19H25ClN2O and molecular weight 332.16553 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-methyl-5-[(E)-2-[2-(2-piperidin-1-ylethyl)phenyl]ethenyl]-1,2-oxazole;hydrochloride
Also Known As: (E)-1-(2-(2-(2-(3-Methyl-5-isoxazolyl)ethenyl)phenoxy)ethyl)piperidine monohydrochloride, Piperidine, 1-(2-(2-(2-(3-methyl-5-isoxazolyl)ethenyl)phenoxy)ethyl)-, monohydrochloride, (E)-, (E)-1-(2-(2-(2-(3-Methyl-5-isoxazolyl)ethenyl)phenoxy)ethyl)piperidine monohydrochloride, 3-methyl-5-[(E)-2-[2-(2-piperidin-1-ylethyl)phenyl]ethenyl]-1,2-oxazole;hydrochloride, 3-methyl-5-[(E)-2-[2-(2-piperidin-1-ylethyl)phenyl]ethenyl]-1,2-oxazole hydrochloride
| Molecular Formula | C19H25ClN2O |
| Molecular Weight | 332.16553 g/mol |
| XLogP | 4.60362 |
| Topological Polar Surface Area (TPSA) | 29.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 332.16553 Da |
| Heavy Atoms | 23 |
| Complexity | 351.0 |
| SMILES | CC1=NOC(=C1)/C=C/C2=CC=CC=C2CCN3CCCCC3.Cl |
| InChIKey | YUHXAPRRVWXISL-RRABGKBLSA-N |
The XLogP value of 4.60362 indicates that RefChem:1096153 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.3 Ų, RefChem:1096153 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1096153 has 1 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 RefChem:1096153 is 139193-88-7.
The molecular formula of RefChem:1096153 is C19H25ClN2O.
The molecular weight of RefChem:1096153 is 332.16553 g/mol.
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