TL;DR: 4(3H)-Quinazolinone, 3-(3,5-dimethyl-4-hydroxyphenyl)-2-propyl- (CAS 28513-42-0) is a chemical compound with molecular formula C19H20N2O2 and molecular weight 308.15247 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(4-hydroxy-3,5-dimethylphenyl)-2-propylquinazolin-4-one
Also Known As: 5-24-03-00322 (Beilstein Handbook Reference), 4(3H)-Quinazolinone, 3-(3,5-dimethyl-4-hydroxyphenyl)-2-propyl-, 3-(4-Hydroxy-3,5-xylyl)-2-propyl-4(3H)-quinazolinone, 4(3H)-Quinazolinone, 3-(4-hydroxy-3,5-xylyl)-2-propyl-, 3-(4-hydroxy-3,5-dimethylphenyl)-2-propylquinazolin-4-one
| Molecular Formula | C19H20N2O2 |
| Molecular Weight | 308.15247 g/mol |
| XLogP | 3.6 |
| Topological Polar Surface Area (TPSA) | 52.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 308.15247 Da |
| Heavy Atoms | 23 |
| Complexity | 464.0 |
| SMILES | CCCC1=NC2=CC=CC=C2C(=O)N1C3=CC(=C(C(=C3)C)O)C |
| InChIKey | YXIWNSLZQISSPB-UHFFFAOYSA-N |
The XLogP value of 3.6 indicates that 4(3H)-Quinazolinone, 3-(3,5-dimethyl-4-hydroxyphenyl)-2-propyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.9 Ų, 4(3H)-Quinazolinone, 3-(3,5-dimethyl-4-hydroxyphenyl)-2-propyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4(3H)-Quinazolinone, 3-(3,5-dimethyl-4-hydroxyphenyl)-2-propyl- has 1 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-(3,5-dimethyl-4-hydroxyphenyl)-2-propyl- is 28513-42-0.
The molecular formula of 4(3H)-Quinazolinone, 3-(3,5-dimethyl-4-hydroxyphenyl)-2-propyl- is C19H20N2O2.
The molecular weight of 4(3H)-Quinazolinone, 3-(3,5-dimethyl-4-hydroxyphenyl)-2-propyl- is 308.15247 g/mol.
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