TL;DR: BN 52719 (CAS 146883-71-8) is a chemical compound with molecular formula C22H48N3O7P and molecular weight 497.323 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[3-(12-aminododecoxy)-2-(methylcarbamoyloxy)propyl] 2-(trimethylazaniumyl)ethyl phosphate
Also Known As: BN 52719, [3-(12-aminododecoxy)-2-(methylcarbamoyloxy)propyl] 2-(trimethylazaniumyl)ethyl phosphate, 3,5,8-Trioxa-11-aza-4-phosphadodecan-1-aminium, 7-(((12-aminododecyl)oxy)methyl)-4-hydroxy-N,N,N-trimethyl-9-oxo-, inner salt, 4-oxide, 3-[(12-Aminododecyl)oxy]-2-[hydroxy(methylimino)methoxy]propyl 2-(trimethylazaniumyl)ethyl phosphate
| Molecular Formula | C22H48N3O7P |
| Molecular Weight | 497.323 g/mol |
| XLogP | 2.3 |
| Topological Polar Surface Area (TPSA) | 132.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 23 |
| Exact Mass | 497.323 Da |
| Heavy Atoms | 33 |
| Complexity | 524.0 |
| SMILES | CNC(=O)OC(COCCCCCCCCCCCCN)COP(=O)([O-])OCC[N+](C)(C)C |
| InChIKey | JDANUPKNNJMGGB-UHFFFAOYSA-N |
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BN 52719. The TPSA of 132.0 Ų falls within the moderate polarity range, balancing permeability and solubility for BN 52719. Following Lipinski's Rule of Five, BN 52719 has 2 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of BN 52719 is 146883-71-8.
The molecular formula of BN 52719 is C22H48N3O7P.
The molecular weight of BN 52719 is 497.323 g/mol.
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