TL;DR: 2-Amino-1-naphthylglucosiduronic acid (CAS 63976-07-8) is a chemical compound with molecular formula C16H17NO7 and molecular weight 335.1005 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6-(2-aminonaphthalen-1-yl)oxy-2,4,5-trihydroxyoxane-2-carboxylic acid
Also Known As: 2-Amino-1-naphthylglucosiduronic acid, 2-Naphthylamine-1-D-glucosiduronic acid, 1-D-Glucosiduronic acid, (2'-aminonaphthyl)-, 4-18-00-05144 (Beilstein Handbook Reference), 6-(2-aminonaphthalen-1-yl)oxy-2,4,5-trihydroxyoxane-2-carboxylic acid
| Molecular Formula | C16H17NO7 |
| Molecular Weight | 335.1005 g/mol |
| XLogP | 0.2 |
| Topological Polar Surface Area (TPSA) | 142.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 3 |
| Exact Mass | 335.1005 Da |
| Heavy Atoms | 24 |
| Complexity | 475.0 |
| SMILES | C1C(C(C(OC1(C(=O)O)O)OC2=C(C=CC3=CC=CC=C32)N)O)O |
| InChIKey | GLQLRWHQTYOBHM-UHFFFAOYSA-N |
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Amino-1-naphthylglucosiduronic acid. The TPSA of 142.0 Ų indicates high polarity, suggesting 2-Amino-1-naphthylglucosiduronic acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2-Amino-1-naphthylglucosiduronic acid has 5 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 2-Amino-1-naphthylglucosiduronic acid is 63976-07-8.
The molecular formula of 2-Amino-1-naphthylglucosiduronic acid is C16H17NO7.
The molecular weight of 2-Amino-1-naphthylglucosiduronic acid is 335.1005 g/mol.
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