TL;DR: 4(3H)-Quinazolinone, 2-((4-nitrophenoxy)methyl)-3-(2-pyridinyl)- (CAS 73342-54-8) is a chemical compound with molecular formula C20H14N4O4 and molecular weight 374.1015 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[(4-nitrophenoxy)methyl]-3-pyridin-2-ylquinazolin-4-one
Also Known As: 4(3H)-Quinazolinone, 2-((4-nitrophenoxy)methyl)-3-(2-pyridinyl)-, 5-25-02-00021 (Beilstein Handbook Reference), 2-((4-Nitrophenoxy)methyl)-3-(2-pyridinyl)-4(3H)-quinazolinone, 2-[(4-nitrophenoxy)methyl]-3-pyridin-2-ylquinazolin-4-one, 2-[(4-Nitrophenoxy)methyl]-3-(pyridin-2-yl)quinazolin-4(3H)-one
| Molecular Formula | C20H14N4O4 |
| Molecular Weight | 374.1015 g/mol |
| XLogP | 3.2 |
| Topological Polar Surface Area (TPSA) | 101.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 374.1015 Da |
| Heavy Atoms | 28 |
| Complexity | 612.0 |
| SMILES | C1=CC=C2C(=C1)C(=O)N(C(=N2)COC3=CC=C(C=C3)[N+](=O)[O-])C4=CC=CC=N4 |
| InChIKey | NGBLLQIBGMTADF-UHFFFAOYSA-N |
The XLogP value of 3.2 indicates that 4(3H)-Quinazolinone, 2-((4-nitrophenoxy)methyl)-3-(2-pyridinyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 101.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4(3H)-Quinazolinone, 2-((4-nitrophenoxy)methyl)-3-(2-pyridinyl)-. Following Lipinski's Rule of Five, 4(3H)-Quinazolinone, 2-((4-nitrophenoxy)methyl)-3-(2-pyridinyl)- has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 4(3H)-Quinazolinone, 2-((4-nitrophenoxy)methyl)-3-(2-pyridinyl)- is 73342-54-8.
The molecular formula of 4(3H)-Quinazolinone, 2-((4-nitrophenoxy)methyl)-3-(2-pyridinyl)- is C20H14N4O4.
The molecular weight of 4(3H)-Quinazolinone, 2-((4-nitrophenoxy)methyl)-3-(2-pyridinyl)- is 374.1015 g/mol.
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