TL;DR: 3-[(E)-1-(4-aminophenyl)ethylideneamino]-2-methylquinazolin-4-one (CAS 141736-16-5) is a chemical compound with molecular formula C17H16N4O and molecular weight 292.13242 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[(E)-1-(4-aminophenyl)ethylideneamino]-2-methylquinazolin-4-one
Also Known As: 3-[(E)-1-(4-aminophenyl)ethylideneamino]-2-methylquinazolin-4-one, 3-{[1-(4-aminophenyl)ethylidene]amino}-2-methyl-4(3H)-quinazolinone, AE-848/15342152, (E)-3-((1-(4-aminophenyl)ethylidene)amino)-2-methylquinazolin-4(3H)-one, 3-{[(1E)-1-(4-aminophenyl)ethylidene]amino}-2-methylquinazolin-4(3H)-one
| Molecular Formula | C17H16N4O |
| Molecular Weight | 292.13242 g/mol |
| XLogP | 2.0 |
| Topological Polar Surface Area (TPSA) | 71.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 292.13242 Da |
| Heavy Atoms | 22 |
| Complexity | 491.0 |
| SMILES | CC1=NC2=CC=CC=C2C(=O)N1/N=C(\C)/C3=CC=C(C=C3)N |
| InChIKey | VKVOINBQKRMQNT-RGVLZGJSSA-N |
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[(E)-1-(4-aminophenyl)ethylideneamino]-2-methylquinazolin-4-one. The TPSA of 71.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[(E)-1-(4-aminophenyl)ethylideneamino]-2-methylquinazolin-4-one. Following Lipinski's Rule of Five, 3-[(E)-1-(4-aminophenyl)ethylideneamino]-2-methylquinazolin-4-one has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 3-[(E)-1-(4-aminophenyl)ethylideneamino]-2-methylquinazolin-4-one is 141736-16-5.
The molecular formula of 3-[(E)-1-(4-aminophenyl)ethylideneamino]-2-methylquinazolin-4-one is C17H16N4O.
The molecular weight of 3-[(E)-1-(4-aminophenyl)ethylideneamino]-2-methylquinazolin-4-one is 292.13242 g/mol.
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