TL;DR: Quinoline, 2-(phenethylaminomethyl)-, dihydrochloride (CAS 27114-19-8) is a chemical compound with molecular formula C18H20Cl2N2 and molecular weight 334.10034 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-phenyl-N-(quinolin-2-ylmethyl)ethanamine;dihydrochloride
Also Known As: 2-(Phenethylaminomethyl)quinoline dihydrochloride, Quinoline, 2-(phenethylaminomethyl)-, dihydrochloride, 2-phenyl-n-(quinolin-2-ylmethyl)ethanamine dihydrochloride, Quinoline, 2-[(phenethylamino)methyl]-, dihydrochloride, 2-Phenyl-N-[(quinolin-2-yl)methyl]ethan-1-amine--hydrogen chloride (1/2)
| Molecular Formula | C18H20Cl2N2 |
| Molecular Weight | 334.10034 g/mol |
| XLogP | 4.41 |
| Topological Polar Surface Area (TPSA) | 24.9 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 334.10034 Da |
| Heavy Atoms | 22 |
| Complexity | 273.0 |
| SMILES | C1=CC=C(C=C1)CCNCC2=NC3=CC=CC=C3C=C2.Cl.Cl |
| InChIKey | FKSJEYYFXJIKAK-UHFFFAOYSA-N |
The XLogP value of 4.41 indicates that Quinoline, 2-(phenethylaminomethyl)-, dihydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 24.9 Ų, Quinoline, 2-(phenethylaminomethyl)-, dihydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Quinoline, 2-(phenethylaminomethyl)-, dihydrochloride has 3 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 Quinoline, 2-(phenethylaminomethyl)-, dihydrochloride is 27114-19-8.
The molecular formula of Quinoline, 2-(phenethylaminomethyl)-, dihydrochloride is C18H20Cl2N2.
The molecular weight of Quinoline, 2-(phenethylaminomethyl)-, dihydrochloride is 334.10034 g/mol.
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