TL;DR: Pyrimidine, 2-((2-(dimethylamino)ethyl)(p-methoxybenzyl)amino)-4-methyl- (CAS 109036-85-3) is a chemical compound with molecular formula C17H24N4O and molecular weight 300.195 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N'-[(4-methoxyphenyl)methyl]-N,N-dimethyl-N'-(4-methylpyrimidin-2-yl)ethane-1,2-diamine
Also Known As: 4-25-00-02156 (Beilstein Handbook Reference), Pyrimidine, 2-((2-(dimethylamino)ethyl)(p-methoxybenzyl)amino)-4-methyl-, 2-((2-(Dimethylamino)ethyl)(p-methoxybenzyl)amino)-4-methylpyrimidine, N-[2-(Dimethylamino)ethyl]-N-(4-methoxybenzyl)-4-methylpyrimidin-2-amine, N'-[(4-methoxyphenyl)methyl]-N,N-dimethyl-N'-(4-methylpyrimidin-2-yl)ethane-1,2-diamine
| Molecular Formula | C17H24N4O |
| Molecular Weight | 300.195 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 41.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 300.195 Da |
| Heavy Atoms | 22 |
| Complexity | 305.0 |
| SMILES | CC1=NC(=NC=C1)N(CCN(C)C)CC2=CC=C(C=C2)OC |
| InChIKey | YSQHRUDCGQECDO-UHFFFAOYSA-N |
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pyrimidine, 2-((2-(dimethylamino)ethyl)(p-methoxybenzyl)amino)-4-methyl-. With a topological polar surface area (TPSA) of 41.5 Ų, Pyrimidine, 2-((2-(dimethylamino)ethyl)(p-methoxybenzyl)amino)-4-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pyrimidine, 2-((2-(dimethylamino)ethyl)(p-methoxybenzyl)amino)-4-methyl- has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Pyrimidine, 2-((2-(dimethylamino)ethyl)(p-methoxybenzyl)amino)-4-methyl- is 109036-85-3.
The molecular formula of Pyrimidine, 2-((2-(dimethylamino)ethyl)(p-methoxybenzyl)amino)-4-methyl- is C17H24N4O.
The molecular weight of Pyrimidine, 2-((2-(dimethylamino)ethyl)(p-methoxybenzyl)amino)-4-methyl- is 300.195 g/mol.
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