TL;DR: PHOSPHORAMIDON SODIUM (CAS 119942-99-3) is a chemical compound with molecular formula C23H34N3NaO10P and molecular weight 566.1879 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
Also Known As: PHOSPHORAMIDON SODIUM, 2-[[2-[[hydroxy-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyphosphoryl]amino]-4-methylpentanoyl]amino]-3-(1H-indol-3-yl)propanoic acid; sodium
| Molecular Formula | C23H34N3NaO10P |
| Molecular Weight | 566.1879 g/mol |
| XLogP | -0.1522 |
| Topological Polar Surface Area (TPSA) | 211.0 Ų |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 11 |
| Exact Mass | 566.1879 Da |
| Heavy Atoms | 38 |
| Complexity | 848.0 |
| SMILES | CC1C(C(C(C(O1)OP(=O)(NC(CC(C)C)C(=O)NC(CC2=CNC3=CC=CC=C32)C(=O)O)O)O)O)O.[Na] |
| InChIKey | KITONROGOABYFZ-UHFFFAOYSA-N |
The XLogP value of -0.1522 indicates that PHOSPHORAMIDON SODIUM is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 211.0 Ų indicates high polarity, suggesting PHOSPHORAMIDON SODIUM may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, PHOSPHORAMIDON SODIUM has 8 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of PHOSPHORAMIDON SODIUM is 119942-99-3.
The molecular formula of PHOSPHORAMIDON SODIUM is C23H34N3NaO10P.
The molecular weight of PHOSPHORAMIDON SODIUM is 566.1879 g/mol.
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