TL;DR: 4(3H)-Quinazolinone, 3-furfuryl-2-methyl- (CAS 30954-37-1) is a chemical compound with molecular formula C14H12N2O2 and molecular weight 240.08987 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(furan-2-ylmethyl)-2-methylquinazolin-4-one
Also Known As: 4(3H)-Quinazolinone, 3-furfuryl-2-methyl-, 3-Furfuryl-2-methyl-4(3H)-quinazolinone, 3-(furan-2-ylmethyl)-2-methylquinazolin-4-one, 5-24-03-00161 (Beilstein Handbook Reference), 3-(furan-2-ylmethyl)-2-methylquinazolin-4(3H)-one
| Molecular Formula | C14H12N2O2 |
| Molecular Weight | 240.08987 g/mol |
| XLogP | 1.5 |
| Topological Polar Surface Area (TPSA) | 45.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 240.08987 Da |
| Heavy Atoms | 18 |
| Complexity | 367.0 |
| Solubility | >36 [ug/mL] (The mean of the results at pH 7.4) |
| SMILES | CC1=NC2=CC=CC=C2C(=O)N1CC3=CC=CO3 |
| InChIKey | BTDIUAJMSNMMKD-UHFFFAOYSA-N |
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4(3H)-Quinazolinone, 3-furfuryl-2-methyl-. With a topological polar surface area (TPSA) of 45.8 Ų, 4(3H)-Quinazolinone, 3-furfuryl-2-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4(3H)-Quinazolinone, 3-furfuryl-2-methyl- 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-furfuryl-2-methyl- is 30954-37-1.
The molecular formula of 4(3H)-Quinazolinone, 3-furfuryl-2-methyl- is C14H12N2O2.
The molecular weight of 4(3H)-Quinazolinone, 3-furfuryl-2-methyl- is 240.08987 g/mol.
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