TL;DR: Benzo(g)quinolinium, 1-((4-chlorophenyl)methyl)-4-((2-(diethylamino)ethyl)amino)- (CAS 127156-37-0) is a chemical compound with molecular formula C26H29ClN3+ and molecular weight 418.205 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[1-[(4-chlorophenyl)methyl]benzo[g]quinolin-1-ium-4-yl]-N',N'-diethylethane-1,2-diamine
Also Known As: Benzo(g)quinolinium, 1-((4-chlorophenyl)methyl)-4-((2-(diethylamino)ethyl)amino)-, 1-[(4-Chlorophenyl)methyl]-4-{[2-(diethylamino)ethyl]amino}benzo[g]quinolin-1-ium, N-[1-[(4-chlorophenyl)methyl]benzo[g]quinolin-1-ium-4-yl]-N',N'-diethylethane-1,2-diamine
| Molecular Formula | C26H29ClN3+ |
| Molecular Weight | 418.205 g/mol |
| XLogP | 6.2 |
| Topological Polar Surface Area (TPSA) | 19.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 8 |
| Exact Mass | 418.205 Da |
| Heavy Atoms | 30 |
| Complexity | 503.0 |
| SMILES | CCN(CC)CCNC1=CC=[N+](C2=CC3=CC=CC=C3C=C12)CC4=CC=C(C=C4)Cl |
| InChIKey | QSWUHCMPWCOBGG-UHFFFAOYSA-O |
The XLogP value of 6.2 indicates that Benzo(g)quinolinium, 1-((4-chlorophenyl)methyl)-4-((2-(diethylamino)ethyl)amino)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 19.2 Ų, Benzo(g)quinolinium, 1-((4-chlorophenyl)methyl)-4-((2-(diethylamino)ethyl)amino)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzo(g)quinolinium, 1-((4-chlorophenyl)methyl)-4-((2-(diethylamino)ethyl)amino)- has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Benzo(g)quinolinium, 1-((4-chlorophenyl)methyl)-4-((2-(diethylamino)ethyl)amino)- is 127156-37-0.
The molecular formula of Benzo(g)quinolinium, 1-((4-chlorophenyl)methyl)-4-((2-(diethylamino)ethyl)amino)- is C26H29ClN3+.
The molecular weight of Benzo(g)quinolinium, 1-((4-chlorophenyl)methyl)-4-((2-(diethylamino)ethyl)amino)- is 418.205 g/mol.
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