TL;DR: (2R,3R,4S,5S,6R)-2-(4-aminophenoxy)-6-(hydroxymethyl)oxane-3,4,5-triol (CAS 5094-33-7) is a chemical compound with molecular formula C12H17NO6 and molecular weight 271.1056 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(4-aminophenoxy)-6-(hydroxymethyl)oxane-3,4,5-triol
Also Known As: p-AmPh mannose, 4-Aminophenylmannoside, 4-aminophenyl hexopyranoside, p-aminophenyl-hexopyranoside, p-Aminophenyl b-D-galactoside
Top 5 of 4 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C12H17NO6 |
| Molecular Weight | 271.1056 g/mol |
| XLogP | -1.0 |
| Topological Polar Surface Area (TPSA) | 125.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 271.1056 Da |
| Heavy Atoms | 19 |
| Complexity | 283.0 |
| SMILES | C1=CC(=CC=C1N)OC2C(C(C(C(O2)CO)O)O)O |
| InChIKey | MIAKOEWBCMPCQR-UHFFFAOYSA-N |
The XLogP value of -1.0 indicates that (2R,3R,4S,5S,6R)-2-(4-aminophenoxy)-6-(hydroxymethyl)oxane-3,4,5-triol is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 125.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (2R,3R,4S,5S,6R)-2-(4-aminophenoxy)-6-(hydroxymethyl)oxane-3,4,5-triol. Following Lipinski's Rule of Five, (2R,3R,4S,5S,6R)-2-(4-aminophenoxy)-6-(hydroxymethyl)oxane-3,4,5-triol has 5 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of (2R,3R,4S,5S,6R)-2-(4-aminophenoxy)-6-(hydroxymethyl)oxane-3,4,5-triol is 5094-33-7.
The molecular formula of (2R,3R,4S,5S,6R)-2-(4-aminophenoxy)-6-(hydroxymethyl)oxane-3,4,5-triol is C12H17NO6.
The molecular weight of (2R,3R,4S,5S,6R)-2-(4-aminophenoxy)-6-(hydroxymethyl)oxane-3,4,5-triol is 271.1056 g/mol.
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