TL;DR: Ethyl 6,8-dimethyl-4-[(3-methylphenyl)amino]quinoline-3-carboxylate (CAS 383893-20-7) is a chemical compound with molecular formula C21H22N2O2 and molecular weight 334.16812 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl 6,8-dimethyl-4-(3-methylanilino)quinoline-3-carboxylate
Also Known As: ethyl 6,8-dimethyl-4-[(3-methylphenyl)amino]quinoline-3-carboxylate, ethyl 6,8-dimethyl-4-(m-tolylamino)quinoline-3-carboxylate, ethyl 6,8-dimethyl-4-(3-methylanilino)quinoline-3-carboxylate
| Molecular Formula | C21H22N2O2 |
| Molecular Weight | 334.16812 g/mol |
| XLogP | 5.6 |
| Topological Polar Surface Area (TPSA) | 51.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 334.16812 Da |
| Heavy Atoms | 25 |
| Complexity | 455.0 |
| SMILES | CCOC(=O)C1=C(C2=CC(=CC(=C2N=C1)C)C)NC3=CC=CC(=C3)C |
| InChIKey | HXIQEXALCYFXNZ-UHFFFAOYSA-N |
The XLogP value of 5.6 indicates that Ethyl 6,8-dimethyl-4-[(3-methylphenyl)amino]quinoline-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.2 Ų, Ethyl 6,8-dimethyl-4-[(3-methylphenyl)amino]quinoline-3-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 6,8-dimethyl-4-[(3-methylphenyl)amino]quinoline-3-carboxylate has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Ethyl 6,8-dimethyl-4-[(3-methylphenyl)amino]quinoline-3-carboxylate is 383893-20-7.
The molecular formula of Ethyl 6,8-dimethyl-4-[(3-methylphenyl)amino]quinoline-3-carboxylate is C21H22N2O2.
The molecular weight of Ethyl 6,8-dimethyl-4-[(3-methylphenyl)amino]quinoline-3-carboxylate is 334.16812 g/mol.
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