TL;DR: Aniline, 4,4'-(octamethylenedioxy)bis(N,N-dimethyl-, hydrochloride (CAS 118924-98-4) is a chemical compound with molecular formula C24H37ClN2O2 and molecular weight 420.25436 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-[8-[4-(dimethylamino)phenoxy]octoxy]-N,N-dimethylaniline;hydrochloride
Also Known As: Aniline, 4,4'-(octamethylenedioxy)bis(N,N-dimethyl-, hydrochloride, 4,4'-(Octamethylenedioxy)bis(N,N-dimethylaniline) hydrochloride, 4-[8-[4-(dimethylamino)phenoxy]octoxy]-N,N-dimethylaniline hydrochloride, 4,4'-[Octane-1,8-diylbis(oxy)]bis(N,N-dimethylaniline)--hydrogen chloride (1/1)
| Molecular Formula | C24H37ClN2O2 |
| Molecular Weight | 420.25436 g/mol |
| XLogP | 6.0388 |
| Topological Polar Surface Area (TPSA) | 24.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 13 |
| Exact Mass | 420.25436 Da |
| Heavy Atoms | 29 |
| Complexity | 337.0 |
| SMILES | CN(C)C1=CC=C(C=C1)OCCCCCCCCOC2=CC=C(C=C2)N(C)C.Cl |
| InChIKey | VQFJEFQNCYIDDX-UHFFFAOYSA-N |
The XLogP value of 6.0388 indicates that Aniline, 4,4'-(octamethylenedioxy)bis(N,N-dimethyl-, hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 24.9 Ų, Aniline, 4,4'-(octamethylenedioxy)bis(N,N-dimethyl-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Aniline, 4,4'-(octamethylenedioxy)bis(N,N-dimethyl-, hydrochloride has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Aniline, 4,4'-(octamethylenedioxy)bis(N,N-dimethyl-, hydrochloride is 118924-98-4.
The molecular formula of Aniline, 4,4'-(octamethylenedioxy)bis(N,N-dimethyl-, hydrochloride is C24H37ClN2O2.
The molecular weight of Aniline, 4,4'-(octamethylenedioxy)bis(N,N-dimethyl-, hydrochloride is 420.25436 g/mol.
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