Disodium 6-amino-5-(phosphonatosulfanylmethyl)-1H-pyrimidin-2-one
TL;DR: Disodium 6-amino-5-(phosphonatosulfanylmethyl)-1H-pyrimidin-2-one (CAS 122916-39-6) is a chemical compound with molecular formula C5H6N3Na2O4PS and molecular weight 280.9612 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
disodium;6-amino-5-(phosphonatosulfanylmethyl)-1H-pyrimidin-2-one
Also Known As: Disodium 6-amino-5-(phosphonatosulfanylmethyl)-1H-pyrimidin-2-one, 1H-Pyrimidin-2-one, 6-amino-5-(phosphonatosulfanylmethyl)-, disodium salt, Disodium 4-amino-5-(phosphonatosulfanylmethyl)-3H-pyrimidin-2-one, Disodium S-[(6-amino-2-oxo-1,2-dihydropyrimidin-5-yl)methyl] phosphorothioate
Technical Specifications
| Molecular Formula | C5H6N3Na2O4PS |
| Molecular Weight | 280.9612 g/mol |
| XLogP | -7.578 |
| Topological Polar Surface Area (TPSA) | 156.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 280.9612 Da |
| Heavy Atoms | 16 |
| Complexity | 348.0 |
| SMILES | C1=NC(=O)NC(=C1CSP(=O)([O-])[O-])N.[Na+].[Na+] |
| InChIKey | CRXZEKGTTACARG-UHFFFAOYSA-L |
Chemical Property Profile of Disodium 6-amino-5-(phosphonatosulfanylmethyl)-1H-pyrimidin-2-one
Property Insights of Disodium 6-amino-5-(phosphonatosulfanylmethyl)-1H-pyrimidin-2-one
The XLogP value of -7.578 indicates that Disodium 6-amino-5-(phosphonatosulfanylmethyl)-1H-pyrimidin-2-one is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 156.0 Ų indicates high polarity, suggesting Disodium 6-amino-5-(phosphonatosulfanylmethyl)-1H-pyrimidin-2-one may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Disodium 6-amino-5-(phosphonatosulfanylmethyl)-1H-pyrimidin-2-one has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Disodium 6-amino-5-(phosphonatosulfanylmethyl)-1H-pyrimidin-2-one?
The CAS number of Disodium 6-amino-5-(phosphonatosulfanylmethyl)-1H-pyrimidin-2-one is 122916-39-6.
What is the molecular formula of Disodium 6-amino-5-(phosphonatosulfanylmethyl)-1H-pyrimidin-2-one?
The molecular formula of Disodium 6-amino-5-(phosphonatosulfanylmethyl)-1H-pyrimidin-2-one is C5H6N3Na2O4PS.
What is the molecular weight of Disodium 6-amino-5-(phosphonatosulfanylmethyl)-1H-pyrimidin-2-one?
The molecular weight of Disodium 6-amino-5-(phosphonatosulfanylmethyl)-1H-pyrimidin-2-one is 280.9612 g/mol.
Where can I buy Disodium 6-amino-5-(phosphonatosulfanylmethyl)-1H-pyrimidin-2-one?
You can request a quote for Disodium 6-amino-5-(phosphonatosulfanylmethyl)-1H-pyrimidin-2-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Disodium 6-amino-5-(phosphonatosulfanylmethyl)-1H-pyrimidin-2-one?
Yes, CoreyChem provides custom synthesis services for Disodium 6-amino-5-(phosphonatosulfanylmethyl)-1H-pyrimidin-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.