TL;DR: 1-([1,1'-Biphenyl]-4-yl)-3-(dimethylamino)prop-2-en-1-one (CAS 1202163-30-1) is a chemical compound with molecular formula C17H17NO and molecular weight 251.13101 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(dimethylamino)-1-(4-phenylphenyl)prop-2-en-1-one
Also Known As: 1-([1,1'-Biphenyl]-4-yl)-3-(dimethylamino)prop-2-en-1-one, 1-[1,1'-biphenyl]-4-yl-3-(dimethylamino)-2-propen-1-one, 3-(dimethylamino)-1-(4-phenylphenyl)prop-2-en-1-one, 2-Propen-1-one,1-[1,1'-biphenyl]-4-yl-3-(dimethylamino)-, (2E)-1-biphenyl-4-yl-3-(dimethylamino)prop-2-en-1-one
| Molecular Formula | C17H17NO |
| Molecular Weight | 251.13101 g/mol |
| XLogP | 3.6 |
| Topological Polar Surface Area (TPSA) | 20.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 251.13101 Da |
| Heavy Atoms | 19 |
| Complexity | 307.0 |
| SMILES | CN(C)C=CC(=O)C1=CC=C(C=C1)C2=CC=CC=C2 |
| InChIKey | VOZCAYLHVNCRJS-UHFFFAOYSA-N |
The XLogP value of 3.6 indicates that 1-([1,1'-Biphenyl]-4-yl)-3-(dimethylamino)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 20.3 Ų, 1-([1,1'-Biphenyl]-4-yl)-3-(dimethylamino)prop-2-en-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-([1,1'-Biphenyl]-4-yl)-3-(dimethylamino)prop-2-en-1-one 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 1-([1,1'-Biphenyl]-4-yl)-3-(dimethylamino)prop-2-en-1-one is 1202163-30-1.
The molecular formula of 1-([1,1'-Biphenyl]-4-yl)-3-(dimethylamino)prop-2-en-1-one is C17H17NO.
The molecular weight of 1-([1,1'-Biphenyl]-4-yl)-3-(dimethylamino)prop-2-en-1-one is 251.13101 g/mol.
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