TL;DR: Diphenoxyphosphoryl(pyridin-4-yl)methanol (CAS 138517-17-6) is a chemical compound with molecular formula C18H16NO4P and molecular weight 341.0817 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
diphenoxyphosphoryl(pyridin-4-yl)methanol
Also Known As: diphenoxyphosphoryl(pyridin-4-yl)methanol, diphenyl hydroxy(4-pyridinyl)methylphosphonate, Diphenoxyphosphoryl-pyridin-4-yl-methanol, 5G-055, diphenyl [hydroxy(pyridin-4-yl)methyl]phosphonate
| Molecular Formula | C18H16NO4P |
| Molecular Weight | 341.0817 g/mol |
| XLogP | 3.0 |
| Topological Polar Surface Area (TPSA) | 68.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 341.0817 Da |
| Heavy Atoms | 24 |
| Complexity | 391.0 |
| SMILES | C1=CC=C(C=C1)OP(=O)(C(C2=CC=NC=C2)O)OC3=CC=CC=C3 |
| InChIKey | IOXPMDDEAPUIQK-UHFFFAOYSA-N |
The XLogP value of 3.0 indicates that Diphenoxyphosphoryl(pyridin-4-yl)methanol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Diphenoxyphosphoryl(pyridin-4-yl)methanol. Following Lipinski's Rule of Five, Diphenoxyphosphoryl(pyridin-4-yl)methanol has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Diphenoxyphosphoryl(pyridin-4-yl)methanol is 138517-17-6.
The molecular formula of Diphenoxyphosphoryl(pyridin-4-yl)methanol is C18H16NO4P.
The molecular weight of Diphenoxyphosphoryl(pyridin-4-yl)methanol is 341.0817 g/mol.
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