TL;DR: 4-[(2,6-dimethylpyridin-1-ium-1-yl)iminomethyl]-N,N-dimethylaniline perchlorate (CAS 121774-63-8) is a chemical compound with molecular formula C16H20ClN3O4 and molecular weight 353.11423 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-[(2,6-dimethylpyridin-1-ium-1-yl)iminomethyl]-N,N-dimethylaniline perchlorate
Also Known As: 2,6-Dimethyl-1-(((4-(dimethylamino)phenyl)methylene)amino)pyridinium perchlorate, Pyridinium, 2,6-dimethyl-1-(((4-(dimethylamino)phenyl)methylene)amino)-, perchlorate
| Molecular Formula | C16H20ClN3O4 |
| Molecular Weight | 353.11423 g/mol |
| XLogP | -2.21686 |
| Topological Polar Surface Area (TPSA) | 93.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 353.11423 Da |
| Heavy Atoms | 24 |
| Complexity | 378.0 |
| SMILES | CC1=[N+](C(=CC=C1)C)N=CC2=CC=C(C=C2)N(C)C.[O-]Cl(=O)(=O)=O |
| InChIKey | BVOGOLDGPOMVSE-UHFFFAOYSA-M |
The XLogP value of -2.21686 indicates that 4-[(2,6-dimethylpyridin-1-ium-1-yl)iminomethyl]-N,N-dimethylaniline perchlorate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 93.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[(2,6-dimethylpyridin-1-ium-1-yl)iminomethyl]-N,N-dimethylaniline perchlorate. Following Lipinski's Rule of Five, 4-[(2,6-dimethylpyridin-1-ium-1-yl)iminomethyl]-N,N-dimethylaniline perchlorate has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 4-[(2,6-dimethylpyridin-1-ium-1-yl)iminomethyl]-N,N-dimethylaniline perchlorate is 121774-63-8.
The molecular formula of 4-[(2,6-dimethylpyridin-1-ium-1-yl)iminomethyl]-N,N-dimethylaniline perchlorate is C16H20ClN3O4.
The molecular weight of 4-[(2,6-dimethylpyridin-1-ium-1-yl)iminomethyl]-N,N-dimethylaniline perchlorate is 353.11423 g/mol.
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