TL;DR: 2-(4-chlorophenyl)-3-(6-(2-ethoxyphenoxy)hexyl)quinazolin-4(3H)-one (CAS 381191-71-5) is a chemical compound with molecular formula C28H29ClN2O3 and molecular weight 476.18668 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(4-chlorophenyl)-3-[6-(2-ethoxyphenoxy)hexyl]quinazolin-4-one
Also Known As: 2-(4-chlorophenyl)-3-[6-(2-ethoxyphenoxy)hexyl]quinazolin-4-one, 2-(4-chlorophenyl)-3-(6-(2-ethoxyphenoxy)hexyl)quinazolin-4(3H)-one, 2-(4-chlorophenyl)-3-[6-(2-ethoxyphenoxy)hexyl]quinazolin-4(3H)-one
| Molecular Formula | C28H29ClN2O3 |
| Molecular Weight | 476.18668 g/mol |
| XLogP | 6.6 |
| Topological Polar Surface Area (TPSA) | 51.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 11 |
| Exact Mass | 476.18668 Da |
| Heavy Atoms | 34 |
| Complexity | 664.0 |
| SMILES | CCOC1=CC=CC=C1OCCCCCCN2C(=NC3=CC=CC=C3C2=O)C4=CC=C(C=C4)Cl |
| InChIKey | VDCVEBKELNYVRK-UHFFFAOYSA-N |
The XLogP value of 6.6 indicates that 2-(4-chlorophenyl)-3-(6-(2-ethoxyphenoxy)hexyl)quinazolin-4(3H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.1 Ų, 2-(4-chlorophenyl)-3-(6-(2-ethoxyphenoxy)hexyl)quinazolin-4(3H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-chlorophenyl)-3-(6-(2-ethoxyphenoxy)hexyl)quinazolin-4(3H)-one has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 2-(4-chlorophenyl)-3-(6-(2-ethoxyphenoxy)hexyl)quinazolin-4(3H)-one is 381191-71-5.
The molecular formula of 2-(4-chlorophenyl)-3-(6-(2-ethoxyphenoxy)hexyl)quinazolin-4(3H)-one is C28H29ClN2O3.
The molecular weight of 2-(4-chlorophenyl)-3-(6-(2-ethoxyphenoxy)hexyl)quinazolin-4(3H)-one is 476.18668 g/mol.
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