TL;DR: 2-Propen-1-one, 3-[4-(diethylamino)phenyl]-1-(4-methylphenyl)- (CAS 110829-93-1) is a chemical compound with molecular formula C20H23NO and molecular weight 293.17798 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[4-(diethylamino)phenyl]-1-(4-methylphenyl)prop-2-en-1-one
Also Known As: 3-[4-(diethylamino)phenyl]-1-(4-methylphenyl)prop-2-en-1-one, 2-Propen-1-one, 3-[4-(diethylamino)phenyl]-1-(4-methylphenyl)-, 3-(4-diethylaminophenyl)-1-(4-methylphenyl)prop-2-en-1-one, 2-Propen-1-one,3-[4-(diethylamino)phenyl]-1-(4-methylphenyl)
| Molecular Formula | C20H23NO |
| Molecular Weight | 293.17798 g/mol |
| XLogP | 4.9 |
| Topological Polar Surface Area (TPSA) | 20.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 293.17798 Da |
| Heavy Atoms | 22 |
| Complexity | 356.0 |
| SMILES | CCN(CC)C1=CC=C(C=C1)C=CC(=O)C2=CC=C(C=C2)C |
| InChIKey | GOHYMFVFZLTJER-UHFFFAOYSA-N |
The XLogP value of 4.9 indicates that 2-Propen-1-one, 3-[4-(diethylamino)phenyl]-1-(4-methylphenyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.3 Ų, 2-Propen-1-one, 3-[4-(diethylamino)phenyl]-1-(4-methylphenyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Propen-1-one, 3-[4-(diethylamino)phenyl]-1-(4-methylphenyl)- has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2-Propen-1-one, 3-[4-(diethylamino)phenyl]-1-(4-methylphenyl)- is 110829-93-1.
The molecular formula of 2-Propen-1-one, 3-[4-(diethylamino)phenyl]-1-(4-methylphenyl)- is C20H23NO.
The molecular weight of 2-Propen-1-one, 3-[4-(diethylamino)phenyl]-1-(4-methylphenyl)- is 293.17798 g/mol.
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