TL;DR: Aniline, N,N-dimethyl-4,4'-methylenedi- (CAS 83322-98-9) is a chemical compound with molecular formula C15H18N2 and molecular weight 226.147 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-[[4-(dimethylamino)phenyl]methyl]aniline
Also Known As: N,N-Dimethyl-4,4'-methylenedianiline, ANILINE, N,N-DIMETHYL-4,4'-METHYLENEDI-, 4-(4-Aminobenzyl)-N,N-dimethylaniline, 4-[(4-dimethylaminophenyl)methyl]aniline, 4-[[4-(dimethylamino)phenyl]methyl]aniline
Top 5 of 8 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C15H18N2 |
| Molecular Weight | 226.147 g/mol |
| XLogP | 2.4 |
| Topological Polar Surface Area (TPSA) | 29.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 226.147 Da |
| Heavy Atoms | 17 |
| Complexity | 211.0 |
| SMILES | CN(C)C1=CC=C(C=C1)CC2=CC=C(C=C2)N |
| InChIKey | KEZSNCVCAQSBLU-UHFFFAOYSA-N |
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Aniline, N,N-dimethyl-4,4'-methylenedi-. With a topological polar surface area (TPSA) of 29.3 Ų, Aniline, N,N-dimethyl-4,4'-methylenedi- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Aniline, N,N-dimethyl-4,4'-methylenedi- has 1 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 Aniline, N,N-dimethyl-4,4'-methylenedi- is 83322-98-9.
The molecular formula of Aniline, N,N-dimethyl-4,4'-methylenedi- is C15H18N2.
The molecular weight of Aniline, N,N-dimethyl-4,4'-methylenedi- is 226.147 g/mol.
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