TL;DR: EINECS 241-056-8 (CAS 16978-42-0) is a chemical compound with molecular formula C10H16N3O4+ and molecular weight 242.11407 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(2,4-dioxo-1H-pyrimidine-6-carbonyl)oxyethyl-trimethylazanium
2-(2,4-dioxo-1H-pyrimidine-6-carbonyl)oxyethyl-trimethylazanium
Also Known As: 2-(2,4-dioxo-1H-pyrimidine-6-carbonyl)oxyethyl-trimethylazanium, (2-(((1,2,3,6-Tetrahydro-2,6-dioxo-4-pyrimidyl)carbonyl)oxy)ethyl)trimethylammonium, [2-[[(1,2,3,6-tetrahydro-2,6-dioxo-4-pyrimidyl)carbonyl]oxy]ethyl]trimethylammonium, 2-(2,6-dioxo3h-pyrimidine-4-carbonyl)oxyethyl-trimethylazanium, Choline 1,2,3,6-tetrahydro-2,6-dioxopyrimidine-4-carboxylate
Top 5 of 1 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C10H16N3O4+ |
| Molecular Weight | 242.11407 g/mol |
| XLogP | -0.9 |
| Topological Polar Surface Area (TPSA) | 84.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 242.11407 Da |
| Heavy Atoms | 17 |
| Complexity | 382.0 |
| SMILES | C[N+](C)(C)CCOC(=O)C1=CC(=O)NC(=O)N1 |
| InChIKey | WVKGFOLHMRECQI-UHFFFAOYSA-O |
The XLogP value of -0.9 indicates that EINECS 241-056-8 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 84.5 Ų falls within the moderate polarity range, balancing permeability and solubility for EINECS 241-056-8. Following Lipinski's Rule of Five, EINECS 241-056-8 has 2 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 EINECS 241-056-8 is 16978-42-0.
The molecular formula of EINECS 241-056-8 is C10H16N3O4+.
The molecular weight of EINECS 241-056-8 is 242.11407 g/mol.
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