TL;DR: 3-Hydroxy-2-phenyl-quinazoline-4-thione (CAS 13961-53-0) is a chemical compound with molecular formula C14H10N2OS and molecular weight 254.05139 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-hydroxy-2-phenylquinazoline-4-thione
Also Known As: 3-hydroxy-2-phenyl-quinazoline-4-thione, 3-hydroxy-2-phenylquinazoline-4-thione, NCI60_030734, 3-Hydroxy-2-phenyl-4(3H)-quinazolinethione, 3-Hydroxy-2-phenylquinazoline-4(3H)-thione
| Molecular Formula | C14H10N2OS |
| Molecular Weight | 254.05139 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 67.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 254.05139 Da |
| Heavy Atoms | 18 |
| Complexity | 363.0 |
| SMILES | C1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=S)N2O |
| InChIKey | KNLKNECMXAABMH-UHFFFAOYSA-N |
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Hydroxy-2-phenyl-quinazoline-4-thione. The TPSA of 67.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Hydroxy-2-phenyl-quinazoline-4-thione. Following Lipinski's Rule of Five, 3-Hydroxy-2-phenyl-quinazoline-4-thione 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 3-Hydroxy-2-phenyl-quinazoline-4-thione is 13961-53-0.
The molecular formula of 3-Hydroxy-2-phenyl-quinazoline-4-thione is C14H10N2OS.
The molecular weight of 3-Hydroxy-2-phenyl-quinazoline-4-thione is 254.05139 g/mol.
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