TL;DR: ethyl 7-chloro-4-((furan-2-ylmethyl)amino)-8-methylquinoline-3-carboxylate hydrochloride (CAS 1052404-50-8) is a chemical compound with molecular formula C18H18Cl2N2O3 and molecular weight 380.06946 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl 7-chloro-4-(furan-2-ylmethylamino)-8-methylquinoline-3-carboxylate;hydrochloride
Also Known As: ethyl 7-chloro-4-((furan-2-ylmethyl)amino)-8-methylquinoline-3-carboxylate hydrochloride, Ethyl 7-chloro-4-(2-furylmethylamino)-8-methyl-quinoline-3-carboxylate Hydrochloride, ethyl 7-chloro-4-(furan-2-ylmethylamino)-8-methylquinoline-3-carboxylate hydrochloride, ethyl 7-chloro-4-(furan-2-ylmethylamino)-8-methylquinoline-3-carboxylate;hydrochloride, ethyl 7-chloro-4-[(2-furylmethyl)amino]-8-methylquinoline-3-carboxylate, chlor ide
| Molecular Formula | C18H18Cl2N2O3 |
| Molecular Weight | 380.06946 g/mol |
| XLogP | 5.00022 |
| Topological Polar Surface Area (TPSA) | 64.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 380.06946 Da |
| Heavy Atoms | 25 |
| Complexity | 436.0 |
| SMILES | CCOC(=O)C1=CN=C2C(=C(C=CC2=C1NCC3=CC=CO3)Cl)C.Cl |
| InChIKey | HPXNCXOBWMEOHD-UHFFFAOYSA-N |
The XLogP value of 5.00022 indicates that ethyl 7-chloro-4-((furan-2-ylmethyl)amino)-8-methylquinoline-3-carboxylate hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.4 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 7-chloro-4-((furan-2-ylmethyl)amino)-8-methylquinoline-3-carboxylate hydrochloride. Following Lipinski's Rule of Five, ethyl 7-chloro-4-((furan-2-ylmethyl)amino)-8-methylquinoline-3-carboxylate hydrochloride has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of ethyl 7-chloro-4-((furan-2-ylmethyl)amino)-8-methylquinoline-3-carboxylate hydrochloride is 1052404-50-8.
The molecular formula of ethyl 7-chloro-4-((furan-2-ylmethyl)amino)-8-methylquinoline-3-carboxylate hydrochloride is C18H18Cl2N2O3.
The molecular weight of ethyl 7-chloro-4-((furan-2-ylmethyl)amino)-8-methylquinoline-3-carboxylate hydrochloride is 380.06946 g/mol.
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