TL;DR: Ethyl 7,8-dichloro-4-(2-dimethylaminoethylamino)quinoline-3-carboxylate Hydrochloride (CAS 1052404-03-1) is a chemical compound with molecular formula C16H20Cl3N3O2 and molecular weight 391.0621 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl 7,8-dichloro-4-[2-(dimethylamino)ethylamino]quinoline-3-carboxylate;hydrochloride
Also Known As: Ethyl 7,8-dichloro-4-(2-dimethylaminoethylamino)quinoline-3-carboxylate Hydrochloride, ethyl 7,8-dichloro-4-((2-(dimethylamino)ethyl)amino)quinoline-3-carboxylate hydrochloride, ethyl 7,8-dichloro-4-[2-(dimethylamino)ethylamino]quinoline-3-carboxylate;hydrochloride
| Molecular Formula | C16H20Cl3N3O2 |
| Molecular Weight | 391.0621 g/mol |
| XLogP | 4.1136 |
| Topological Polar Surface Area (TPSA) | 54.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 391.0621 Da |
| Heavy Atoms | 24 |
| Complexity | 398.0 |
| SMILES | CCOC(=O)C1=CN=C2C(=C1NCCN(C)C)C=CC(=C2Cl)Cl.Cl |
| InChIKey | ZTCIAUVHDPSZMD-UHFFFAOYSA-N |
The XLogP value of 4.1136 indicates that Ethyl 7,8-dichloro-4-(2-dimethylaminoethylamino)quinoline-3-carboxylate Hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.5 Ų, Ethyl 7,8-dichloro-4-(2-dimethylaminoethylamino)quinoline-3-carboxylate Hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 7,8-dichloro-4-(2-dimethylaminoethylamino)quinoline-3-carboxylate Hydrochloride has 2 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 Ethyl 7,8-dichloro-4-(2-dimethylaminoethylamino)quinoline-3-carboxylate Hydrochloride is 1052404-03-1.
The molecular formula of Ethyl 7,8-dichloro-4-(2-dimethylaminoethylamino)quinoline-3-carboxylate Hydrochloride is C16H20Cl3N3O2.
The molecular weight of Ethyl 7,8-dichloro-4-(2-dimethylaminoethylamino)quinoline-3-carboxylate Hydrochloride is 391.0621 g/mol.
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