TL;DR: (E)-3-(2-chloro-7-methoxyquinolin-3-yl)-1-(furan-2-yl)prop-2-en-1-one (CAS 1164466-95-8) is a chemical compound with molecular formula C17H12ClNO3 and molecular weight 313.05057 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(E)-3-(2-chloro-7-methoxyquinolin-3-yl)-1-(furan-2-yl)prop-2-en-1-one
Also Known As: (E)-3-(2-chloro-7-methoxyquinolin-3-yl)-1-(furan-2-yl)prop-2-en-1-one, (2E)-3-(2-chloro-7-methoxyquinolin-3-yl)-1-(furan-2-yl)prop-2-en-1-one, (E)-3-(2-Chloro-7-methoxy-quinolin-3-yl)-1-furan-2-yl-propenone, (2E)-3-(2-chloro-7-methoxy(3-quinolyl))-1-(2-furyl)prop-2-en-1-one, 3-(2-chloro-7-methoxyquinolin-3-yl)-1-(furan-2-yl)prop-2-en-1-one
| Molecular Formula | C17H12ClNO3 |
| Molecular Weight | 313.05057 g/mol |
| XLogP | 4.3 |
| Topological Polar Surface Area (TPSA) | 52.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 313.05057 Da |
| Heavy Atoms | 22 |
| Complexity | 428.0 |
| SMILES | COC1=CC2=NC(=C(C=C2C=C1)/C=C/C(=O)C3=CC=CO3)Cl |
| InChIKey | KWEFCFANUZRUQS-FNORWQNLSA-N |
The XLogP value of 4.3 indicates that (E)-3-(2-chloro-7-methoxyquinolin-3-yl)-1-(furan-2-yl)prop-2-en-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.3 Ų, (E)-3-(2-chloro-7-methoxyquinolin-3-yl)-1-(furan-2-yl)prop-2-en-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (E)-3-(2-chloro-7-methoxyquinolin-3-yl)-1-(furan-2-yl)prop-2-en-1-one has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of (E)-3-(2-chloro-7-methoxyquinolin-3-yl)-1-(furan-2-yl)prop-2-en-1-one is 1164466-95-8.
The molecular formula of (E)-3-(2-chloro-7-methoxyquinolin-3-yl)-1-(furan-2-yl)prop-2-en-1-one is C17H12ClNO3.
The molecular weight of (E)-3-(2-chloro-7-methoxyquinolin-3-yl)-1-(furan-2-yl)prop-2-en-1-one is 313.05057 g/mol.
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