TL;DR: 4(3H)-Quinazolinone, 3-(2-((1,1'-biphenyl)-4-yloxy)ethyl)- (CAS 138841-12-0) is a chemical compound with molecular formula C22H18N2O2 and molecular weight 342.13684 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[2-(4-phenylphenoxy)ethyl]quinazolin-4-one
Also Known As: 3-[2-(4-phenylphenoxy)ethyl]quinazolin-4-one, 3-(2-([1,1'-Biphenyl]-4-yloxy)ethyl)quinazolin-4(3H)-one, 4(3H)-Quinazolinone, 3-(2-((1,1'-biphenyl)-4-yloxy)ethyl)-, 3-(2-((1,1'-Biphenyl)-4-yloxy)ethyl)-4(3H)-quinazolinone, 3-[2-(4-biphenylyloxy)ethyl]-4(3H)-quinazolinone
Top 5 of 1 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C22H18N2O2 |
| Molecular Weight | 342.13684 g/mol |
| XLogP | 4.2 |
| Topological Polar Surface Area (TPSA) | 41.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 342.13684 Da |
| Heavy Atoms | 26 |
| Complexity | 492.0 |
| SMILES | C1=CC=C(C=C1)C2=CC=C(C=C2)OCCN3C=NC4=CC=CC=C4C3=O |
| InChIKey | XZZKSZKORULQSR-UHFFFAOYSA-N |
The XLogP value of 4.2 indicates that 4(3H)-Quinazolinone, 3-(2-((1,1'-biphenyl)-4-yloxy)ethyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.9 Ų, 4(3H)-Quinazolinone, 3-(2-((1,1'-biphenyl)-4-yloxy)ethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4(3H)-Quinazolinone, 3-(2-((1,1'-biphenyl)-4-yloxy)ethyl)- has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 4(3H)-Quinazolinone, 3-(2-((1,1'-biphenyl)-4-yloxy)ethyl)- is 138841-12-0.
The molecular formula of 4(3H)-Quinazolinone, 3-(2-((1,1'-biphenyl)-4-yloxy)ethyl)- is C22H18N2O2.
The molecular weight of 4(3H)-Quinazolinone, 3-(2-((1,1'-biphenyl)-4-yloxy)ethyl)- is 342.13684 g/mol.
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