TL;DR: Ammonium, dimethyldodecyl(3-(p-aminobenzamido)propyl)-, bromide (CAS 102571-25-5) is a chemical compound with molecular formula C24H44BrN3O and molecular weight 469.26678 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[(4-aminobenzoyl)amino]propyl-dodecyl-dimethylazanium bromide
Also Known As: 3-(p-Aminobenzamido)propyl-dimethyl-dodecyl ammonium bromide, AMMONIUM, DIMETHYLDODECYL(3-(p-AMINOBENZAMIDO)PROPYL)-, BROMIDE, Ammonium, (3-(p-aminobenzamido)propyl)dimethyldodecyl-, bromide, 3-[(4-aminobenzoyl)amino]propyl-dodecyl-dimethylazanium, 3-[(4-aminobenzoyl)amino]propyl-dodecyl-dimethylazanium bromide
| Molecular Formula | C24H44BrN3O |
| Molecular Weight | 469.26678 g/mol |
| XLogP | 2.39 |
| Topological Polar Surface Area (TPSA) | 55.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 16 |
| Exact Mass | 469.26678 Da |
| Heavy Atoms | 29 |
| Complexity | 389.0 |
| SMILES | CCCCCCCCCCCC[N+](C)(C)CCCNC(=O)C1=CC=C(C=C1)N.[Br-] |
| InChIKey | LCMNZUVKTRQDSF-UHFFFAOYSA-N |
The XLogP value of 2.39 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ammonium, dimethyldodecyl(3-(p-aminobenzamido)propyl)-, bromide. With a topological polar surface area (TPSA) of 55.1 Ų, Ammonium, dimethyldodecyl(3-(p-aminobenzamido)propyl)-, bromide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ammonium, dimethyldodecyl(3-(p-aminobenzamido)propyl)-, bromide has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Ammonium, dimethyldodecyl(3-(p-aminobenzamido)propyl)-, bromide is 102571-25-5.
The molecular formula of Ammonium, dimethyldodecyl(3-(p-aminobenzamido)propyl)-, bromide is C24H44BrN3O.
The molecular weight of Ammonium, dimethyldodecyl(3-(p-aminobenzamido)propyl)-, bromide is 469.26678 g/mol.
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