TL;DR: (2E)-3-{[4-(dimethylamino)phenyl]amino}-1-(furan-2-yl)prop-2-en-1-one (CAS 1164474-39-8) is a chemical compound with molecular formula C15H16N2O2 and molecular weight 256.1212 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(E)-3-[4-(dimethylamino)anilino]-1-(furan-2-yl)prop-2-en-1-one
Also Known As: (E)-3-[4-(dimethylamino)anilino]-1-(furan-2-yl)prop-2-en-1-one, 3-{[4-(dimethylamino)phenyl]amino}-1-(2-furyl)-2-propen-1-one, (2E)-3-{[4-(dimethylamino)phenyl]amino}-1-(furan-2-yl)prop-2-en-1-one, (E)-3-((4-(dimethylamino)phenyl)amino)-1-(furan-2-yl)prop-2-en-1-one
| Molecular Formula | C15H16N2O2 |
| Molecular Weight | 256.1212 g/mol |
| XLogP | 3.5 |
| Topological Polar Surface Area (TPSA) | 45.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 256.1212 Da |
| Heavy Atoms | 19 |
| Complexity | 320.0 |
| SMILES | CN(C)C1=CC=C(C=C1)N/C=C/C(=O)C2=CC=CO2 |
| InChIKey | YFYMHEUFROPLBZ-MDZDMXLPSA-N |
The XLogP value of 3.5 indicates that (2E)-3-{[4-(dimethylamino)phenyl]amino}-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 45.5 Ų, (2E)-3-{[4-(dimethylamino)phenyl]amino}-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, (2E)-3-{[4-(dimethylamino)phenyl]amino}-1-(furan-2-yl)prop-2-en-1-one has 1 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 (2E)-3-{[4-(dimethylamino)phenyl]amino}-1-(furan-2-yl)prop-2-en-1-one is 1164474-39-8.
The molecular formula of (2E)-3-{[4-(dimethylamino)phenyl]amino}-1-(furan-2-yl)prop-2-en-1-one is C15H16N2O2.
The molecular weight of (2E)-3-{[4-(dimethylamino)phenyl]amino}-1-(furan-2-yl)prop-2-en-1-one is 256.1212 g/mol.
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