TL;DR: 4(3H)-Quinazolinone, 7-iodo-2-((o-methoxyphenoxy)methyl)-3-(2-pyridyl)- (CAS 75057-66-8) is a chemical compound with molecular formula C21H16IN3O3 and molecular weight 485.02365 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
7-iodo-2-[(2-methoxyphenoxy)methyl]-3-pyridin-2-ylquinazolin-4-one
Also Known As: 5-25-02-00022 (Beilstein Handbook Reference), 4(3H)-Quinazolinone, 7-iodo-2-((o-methoxyphenoxy)methyl)-3-(2-pyridyl)-, 7-Iodo-2-((o-methoxyphenoxy)methyl)-3-(2-pyridyl)-4(3H)-quinazolinone, 7-iodo-2-[(2-methoxyphenoxy)methyl]-3-pyridin-2-ylquinazolin-4-one, 7-Iodo-2-[(2-methoxyphenoxy)methyl]-3-(pyridin-2-yl)quinazolin-4(3H)-one
| Molecular Formula | C21H16IN3O3 |
| Molecular Weight | 485.02365 g/mol |
| XLogP | 4.0 |
| Topological Polar Surface Area (TPSA) | 64.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 485.02365 Da |
| Heavy Atoms | 28 |
| Complexity | 587.0 |
| SMILES | COC1=CC=CC=C1OCC2=NC3=C(C=CC(=C3)I)C(=O)N2C4=CC=CC=N4 |
| InChIKey | KZDXISZRSWHTIW-UHFFFAOYSA-N |
The XLogP value of 4.0 indicates that 4(3H)-Quinazolinone, 7-iodo-2-((o-methoxyphenoxy)methyl)-3-(2-pyridyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4(3H)-Quinazolinone, 7-iodo-2-((o-methoxyphenoxy)methyl)-3-(2-pyridyl)-. Following Lipinski's Rule of Five, 4(3H)-Quinazolinone, 7-iodo-2-((o-methoxyphenoxy)methyl)-3-(2-pyridyl)- has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 4(3H)-Quinazolinone, 7-iodo-2-((o-methoxyphenoxy)methyl)-3-(2-pyridyl)- is 75057-66-8.
The molecular formula of 4(3H)-Quinazolinone, 7-iodo-2-((o-methoxyphenoxy)methyl)-3-(2-pyridyl)- is C21H16IN3O3.
The molecular weight of 4(3H)-Quinazolinone, 7-iodo-2-((o-methoxyphenoxy)methyl)-3-(2-pyridyl)- is 485.02365 g/mol.
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