TL;DR: N-p-Nitrophenyl-D-ribosylamine triacetate (CAS 109527-10-8) is a chemical compound with molecular formula C17H20N2O9 and molecular weight 396.11688 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[(3R,4R,5R)-4,5-diacetyloxy-6-(4-nitroanilino)oxan-3-yl] acetate
Also Known As: N-p-Nitrophenyl-D-ribosylamine triacetate, 2,3,4-tri-O-acetyl-N-(4-nitrophenyl)-D-ribopyranosylamine, 2,3,4-Tri-O-acetyl-N-(4-nitrophenyl)pentopyranosylamine, [(3R,4R,5R)-4,5-diacetyloxy-6-(4-nitroanilino)oxan-3-yl] acetate, CCRIS 3631
| Molecular Formula | C17H20N2O9 |
| Molecular Weight | 396.11688 g/mol |
| XLogP | 1.4 |
| Topological Polar Surface Area (TPSA) | 146.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 8 |
| Exact Mass | 396.11688 Da |
| Heavy Atoms | 28 |
| Complexity | 598.0 |
| SMILES | CC(=O)O[C@@H]1COC([C@@H]([C@@H]1OC(=O)C)OC(=O)C)NC2=CC=C(C=C2)[N+](=O)[O-] |
| InChIKey | AUBLYQAWASNETD-HJNZIYBASA-N |
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-p-Nitrophenyl-D-ribosylamine triacetate. The TPSA of 146.0 Ų indicates high polarity, suggesting N-p-Nitrophenyl-D-ribosylamine triacetate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, N-p-Nitrophenyl-D-ribosylamine triacetate has 1 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of N-p-Nitrophenyl-D-ribosylamine triacetate is 109527-10-8.
The molecular formula of N-p-Nitrophenyl-D-ribosylamine triacetate is C17H20N2O9.
The molecular weight of N-p-Nitrophenyl-D-ribosylamine triacetate is 396.11688 g/mol.
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