TL;DR: 4(5H)-Oxazolone, 2-amino-5-(1-bromo-2-(4-methoxyphenyl)-2-oxoethylidene)- (CAS 155717-86-5) is a chemical compound with molecular formula C12H9BrN2O4 and molecular weight 323.97458 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(5Z)-2-amino-5-[1-bromo-2-(4-methoxyphenyl)-2-oxoethylidene]-1,3-oxazol-4-one
Also Known As: dipotassium tellurate, 2-Amino-5-(1-bromo-2-(4-methoxyphenyl)-2-oxoethylidene)-4(5H)-oxazolone, 4(5H)-Oxazolone, 2-amino-5-(1-bromo-2-(4-methoxyphenyl)-2-oxoethylidene)-, (5Z)-2-amino-5-[1-bromo-2-(4-methoxyphenyl)-2-oxoethylidene]-1,3-oxazol-4-one
| Molecular Formula | C12H9BrN2O4 |
| Molecular Weight | 323.97458 g/mol |
| XLogP | 1.7 |
| Topological Polar Surface Area (TPSA) | 91.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 323.97458 Da |
| Heavy Atoms | 19 |
| Complexity | 464.0 |
| SMILES | COC1=CC=C(C=C1)C(=O)/C(=C/2\C(=O)N=C(O2)N)/Br |
| InChIKey | OZGMDNZABCYHDH-NTMALXAHSA-N |
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4(5H)-Oxazolone, 2-amino-5-(1-bromo-2-(4-methoxyphenyl)-2-oxoethylidene)-. The TPSA of 91.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4(5H)-Oxazolone, 2-amino-5-(1-bromo-2-(4-methoxyphenyl)-2-oxoethylidene)-. Following Lipinski's Rule of Five, 4(5H)-Oxazolone, 2-amino-5-(1-bromo-2-(4-methoxyphenyl)-2-oxoethylidene)- 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 4(5H)-Oxazolone, 2-amino-5-(1-bromo-2-(4-methoxyphenyl)-2-oxoethylidene)- is 155717-86-5.
The molecular formula of 4(5H)-Oxazolone, 2-amino-5-(1-bromo-2-(4-methoxyphenyl)-2-oxoethylidene)- is C12H9BrN2O4.
The molecular weight of 4(5H)-Oxazolone, 2-amino-5-(1-bromo-2-(4-methoxyphenyl)-2-oxoethylidene)- is 323.97458 g/mol.
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