TL;DR: 4-Aminophenylphosphorylcholine (CAS 102185-28-4) is a chemical compound with molecular formula C11H19N2O4P and molecular weight 274.10825 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(4-aminophenyl) 2-(trimethylazaniumyl)ethyl phosphate
Also Known As: 4-Aminophenylphosphorylcholine, PAPPC, p-aminophenylphosphocholine, p-Aminophenylphosphorylcholine, APPC
Top 5 of 6 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C11H19N2O4P |
| Molecular Weight | 274.10825 g/mol |
| XLogP | 0.1 |
| Topological Polar Surface Area (TPSA) | 84.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 274.10825 Da |
| Heavy Atoms | 18 |
| Complexity | 290.0 |
| SMILES | C[N+](C)(C)CCOP(=O)([O-])OC1=CC=C(C=C1)N |
| InChIKey | SBUYBNIDQXQZSZ-UHFFFAOYSA-N |
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Aminophenylphosphorylcholine. The TPSA of 84.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Aminophenylphosphorylcholine. Following Lipinski's Rule of Five, 4-Aminophenylphosphorylcholine 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 4-Aminophenylphosphorylcholine is 102185-28-4.
The molecular formula of 4-Aminophenylphosphorylcholine is C11H19N2O4P.
The molecular weight of 4-Aminophenylphosphorylcholine is 274.10825 g/mol.
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