TL;DR: 2,3-Diphenylquinazoline-4-thione (CAS 13961-48-3) is a chemical compound with molecular formula C20H14N2S and molecular weight 314.08777 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2,3-diphenylquinazoline-4-thione
Also Known As: 2,3-diphenylquinazoline-4-thione, 2,3-Diphenylquinazoline-4(3H)-thione
| Molecular Formula | C20H14N2S |
| Molecular Weight | 314.08777 g/mol |
| XLogP | 4.7 |
| Topological Polar Surface Area (TPSA) | 47.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 314.08777 Da |
| Heavy Atoms | 23 |
| Complexity | 460.0 |
| SMILES | C1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=S)N2C4=CC=CC=C4 |
| InChIKey | BKSWISDIYOAZET-UHFFFAOYSA-N |
The XLogP value of 4.7 indicates that 2,3-Diphenylquinazoline-4-thione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.7 Ų, 2,3-Diphenylquinazoline-4-thione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,3-Diphenylquinazoline-4-thione has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2,3-Diphenylquinazoline-4-thione is 13961-48-3.
The molecular formula of 2,3-Diphenylquinazoline-4-thione is C20H14N2S.
The molecular weight of 2,3-Diphenylquinazoline-4-thione is 314.08777 g/mol.
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