TL;DR: 4(3H)-Quinazolinone, 6-fluoro-3-(2-methoxyphenyl)-2-methyl- (CAS 49579-04-6) is a chemical compound with molecular formula C16H13FN2O2 and molecular weight 284.0961 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6-fluoro-3-(2-methoxyphenyl)-2-methylquinazolin-4-one
Also Known As: 4(3H)-Quinazolinone, 6-fluoro-3-(2-methoxyphenyl)-2-methyl-, 5-24-03-00175 (Beilstein Handbook Reference), 6-Fluoro-3-(2-methoxyphenyl)-2-methyl-4(3H)-quinazolinone, 6-fluoro-3-(2-methoxyphenyl)-2-methylquinazolin-4-one, 6-fluoro-3-(2-methoxyphenyl)-2-methylquinazolin-4(3H)-one
| Molecular Formula | C16H13FN2O2 |
| Molecular Weight | 284.0961 g/mol |
| XLogP | 2.5 |
| Topological Polar Surface Area (TPSA) | 41.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 284.0961 Da |
| Heavy Atoms | 21 |
| Complexity | 440.0 |
| SMILES | CC1=NC2=C(C=C(C=C2)F)C(=O)N1C3=CC=CC=C3OC |
| InChIKey | ANDCPRWZVCFJDY-UHFFFAOYSA-N |
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4(3H)-Quinazolinone, 6-fluoro-3-(2-methoxyphenyl)-2-methyl-. With a topological polar surface area (TPSA) of 41.9 Ų, 4(3H)-Quinazolinone, 6-fluoro-3-(2-methoxyphenyl)-2-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4(3H)-Quinazolinone, 6-fluoro-3-(2-methoxyphenyl)-2-methyl- has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 4(3H)-Quinazolinone, 6-fluoro-3-(2-methoxyphenyl)-2-methyl- is 49579-04-6.
The molecular formula of 4(3H)-Quinazolinone, 6-fluoro-3-(2-methoxyphenyl)-2-methyl- is C16H13FN2O2.
The molecular weight of 4(3H)-Quinazolinone, 6-fluoro-3-(2-methoxyphenyl)-2-methyl- is 284.0961 g/mol.
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