TL;DR: Acetamide, 2-((5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl)amino)-N-(2-methyl-4-oxo-3(4H)-quinazolinyl)- (CAS 135790-31-7) is a chemical compound with molecular formula C19H15BrN6O3 and molecular weight 454.0389 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[[5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]amino]-N-(2-methyl-4-oxoquinazolin-3-yl)acetamide
Also Known As: Acetamide, 2-((5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl)amino)-N-(2-methyl-4-oxo-3(4H)-quinazolinyl)-, 1,3,4-Oxadiazole-2-acetamide, 2-(p-bromophenyl)-N-(2-methyl-4-oxo-3(4H)-quinazolinyl)-, 2-[[5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]amino]-N-(2-methyl-4-oxoquinazolin-3-yl)acetamide, N~2~-[5-(4-Bromophenyl)-1,3,4-oxadiazol-2-yl]-N-(2-methyl-4-oxoquinazolin-3(4H)-yl)glycinamide, BRN 4339009
| Molecular Formula | C19H15BrN6O3 |
| Molecular Weight | 454.0389 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 113.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 454.0389 Da |
| Heavy Atoms | 29 |
| Complexity | 654.0 |
| SMILES | CC1=NC2=CC=CC=C2C(=O)N1NC(=O)CNC3=NN=C(O3)C4=CC=C(C=C4)Br |
| InChIKey | ZSNZXLFTOFORKX-UHFFFAOYSA-N |
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Acetamide, 2-((5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl)amino)-N-(2-methyl-4-oxo-3(4H)-quinazolinyl)-. The TPSA of 113.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Acetamide, 2-((5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl)amino)-N-(2-methyl-4-oxo-3(4H)-quinazolinyl)-. Following Lipinski's Rule of Five, Acetamide, 2-((5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl)amino)-N-(2-methyl-4-oxo-3(4H)-quinazolinyl)- has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Acetamide, 2-((5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl)amino)-N-(2-methyl-4-oxo-3(4H)-quinazolinyl)- is 135790-31-7.
The molecular formula of Acetamide, 2-((5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl)amino)-N-(2-methyl-4-oxo-3(4H)-quinazolinyl)- is C19H15BrN6O3.
The molecular weight of Acetamide, 2-((5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl)amino)-N-(2-methyl-4-oxo-3(4H)-quinazolinyl)- is 454.0389 g/mol.
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