N-Glucopyranosyl-5-aminosalicylic acid
TL;DR: N-Glucopyranosyl-5-aminosalicylic acid (CAS 123135-21-7) is a chemical compound with molecular formula C13H17NO8 and molecular weight 315.09543 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-hydroxy-5-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]amino]benzoic acid
Also Known As: N-Glucopyranosyl-5-asa, Mesalazine N-beta-D-Glucoside, N-Glucopyranosyl-5-aminosalicylic acid, Mesalazine N-?-D-Glucoside, Mesalazine N-
Technical Specifications
| Molecular Formula | C13H17NO8 |
| Molecular Weight | 315.09543 g/mol |
| XLogP | -0.5 |
| Topological Polar Surface Area (TPSA) | 160.0 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 4 |
| Exact Mass | 315.09543 Da |
| Heavy Atoms | 22 |
| Complexity | 394.0 |
| SMILES | C1=CC(=C(C=C1N[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O)C(=O)O)O |
| InChIKey | SJRWBGQWNUAGPK-RMPHRYRLSA-N |
Chemical Property Profile of N-Glucopyranosyl-5-aminosalicylic acid
Property Insights of N-Glucopyranosyl-5-aminosalicylic acid
The XLogP value of -0.5 indicates that N-Glucopyranosyl-5-aminosalicylic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 160.0 Ų indicates high polarity, suggesting N-Glucopyranosyl-5-aminosalicylic acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, N-Glucopyranosyl-5-aminosalicylic acid has 7 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of N-Glucopyranosyl-5-aminosalicylic acid?
The CAS number of N-Glucopyranosyl-5-aminosalicylic acid is 123135-21-7.
What is the molecular formula of N-Glucopyranosyl-5-aminosalicylic acid?
The molecular formula of N-Glucopyranosyl-5-aminosalicylic acid is C13H17NO8.
What is the molecular weight of N-Glucopyranosyl-5-aminosalicylic acid?
The molecular weight of N-Glucopyranosyl-5-aminosalicylic acid is 315.09543 g/mol.
Where can I buy N-Glucopyranosyl-5-aminosalicylic acid?
You can request a quote for N-Glucopyranosyl-5-aminosalicylic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-Glucopyranosyl-5-aminosalicylic acid?
Yes, CoreyChem provides custom synthesis services for N-Glucopyranosyl-5-aminosalicylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.