TL;DR: acetic acid, (((ethylamino)carbonyl)amino)oxo-, monoammonium salt (CAS 1059185-93-1) is a chemical compound with molecular formula C5H11N3O4 and molecular weight 177.07495 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
azanium 2-(ethylcarbamoylamino)-2-oxoacetate
Also Known As: 5-Ethyloxaluric acid ammonium salt, starbld0002104, Acetic acid, (((ethylamino)carbonyl)amino)oxo-, monoammonium salt, Ammonium 2-(3-ethylureido)-2-oxoacetate, azanium;2-(ethylcarbamoylamino)-2-oxoacetate
| Molecular Formula | C5H11N3O4 |
| Molecular Weight | 177.07495 g/mol |
| XLogP | -2.0418 |
| Topological Polar Surface Area (TPSA) | 99.3 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 177.07495 Da |
| Heavy Atoms | 12 |
| Complexity | 183.0 |
| SMILES | CCNC(=O)NC(=O)C(=O)[O-].[NH4+] |
| InChIKey | OIXKHCJUTFWBBL-UHFFFAOYSA-N |
The XLogP value of -2.0418 indicates that acetic acid, (((ethylamino)carbonyl)amino)oxo-, monoammonium salt is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 99.3 Ų falls within the moderate polarity range, balancing permeability and solubility for acetic acid, (((ethylamino)carbonyl)amino)oxo-, monoammonium salt. Following Lipinski's Rule of Five, acetic acid, (((ethylamino)carbonyl)amino)oxo-, monoammonium salt has 3 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 acetic acid, (((ethylamino)carbonyl)amino)oxo-, monoammonium salt is 1059185-93-1.
The molecular formula of acetic acid, (((ethylamino)carbonyl)amino)oxo-, monoammonium salt is C5H11N3O4.
The molecular weight of acetic acid, (((ethylamino)carbonyl)amino)oxo-, monoammonium salt is 177.07495 g/mol.
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