TL;DR: 1,4-Benzenediamine, N1-(1,3-dimethylbutyl)-N4-(4-methylphenyl)- (CAS 16364-15-1) is a chemical compound with molecular formula C19H26N2 and molecular weight 282.2096 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-N-(4-methylpentan-2-yl)-1-N-(4-methylphenyl)benzene-1,4-diamine
Also Known As: AmbkkkkK616, N-(1,3-Dimethylbutyl)-N'-(p-tolyl)benzene-p-diamine, p-Phenylenediamine, N-(1,3-dimethylbutyl)-N'-p-tolyl-, 1,4-Benzenediamine, N-(1,3-dimethylbutyl)-N'-(4-methylphenyl)-, 1,4-Benzenediamine, N1-(1,3-dimethylbutyl)-N4-(4-methylphenyl)-
| Molecular Formula | C19H26N2 |
| Molecular Weight | 282.2096 g/mol |
| XLogP | 5.9 |
| Topological Polar Surface Area (TPSA) | 24.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 282.2096 Da |
| Heavy Atoms | 21 |
| Complexity | 273.0 |
| SMILES | CC1=CC=C(C=C1)NC2=CC=C(C=C2)NC(C)CC(C)C |
| InChIKey | BRHHHNJIRNMRFM-UHFFFAOYSA-N |
The XLogP value of 5.9 indicates that 1,4-Benzenediamine, N1-(1,3-dimethylbutyl)-N4-(4-methylphenyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 24.1 Ų, 1,4-Benzenediamine, N1-(1,3-dimethylbutyl)-N4-(4-methylphenyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,4-Benzenediamine, N1-(1,3-dimethylbutyl)-N4-(4-methylphenyl)- has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 1,4-Benzenediamine, N1-(1,3-dimethylbutyl)-N4-(4-methylphenyl)- is 16364-15-1.
The molecular formula of 1,4-Benzenediamine, N1-(1,3-dimethylbutyl)-N4-(4-methylphenyl)- is C19H26N2.
The molecular weight of 1,4-Benzenediamine, N1-(1,3-dimethylbutyl)-N4-(4-methylphenyl)- is 282.2096 g/mol.
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