(2R,3R,4S,5S,6R)-2-(1H-1,2,3-benzotriazol-1-yl)-6-(hydroxymethyl)oxane-3,4,5-triol
TL;DR: (2R,3R,4S,5S,6R)-2-(1H-1,2,3-benzotriazol-1-yl)-6-(hydroxymethyl)oxane-3,4,5-triol (CAS 4706-40-5) is a chemical compound with molecular formula C12H15N3O5 and molecular weight 281.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R,3R,4S,5S,6R)-2-(benzotriazol-1-yl)-6-(hydroxymethyl)oxane-3,4,5-triol
Also Known As: (2R,3R,4S,5S,6R)-2-(1H-1,2,3-benzotriazol-1-yl)-6-(hydroxymethyl)oxane-3,4,5-triol, (2R,3R,4S,5S,6R)-2-(benzotriazol-1-yl)-6-(hydroxymethyl)oxane-3,4,5-triol, (2R,3R,4S,5S,6R)-2-(1H-benzo[d][1,2,3]triazol-1-yl)-6-(hydroxymethyl)tetrahydro-2H-pyran-3,4,5-triol
| Molecular Formula | C12H15N3O5 |
|---|---|
| Molecular Weight | 281.10 g/mol |
| LogP | -1.5963 |
| Topological Polar Surface Area | 120.86 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 281.10117 |
| Heavy Atoms | 20 |
| Complexity | 601.5452 |
Chemical Identifiers
| CAS Number | 4706-40-5 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N=NN2[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O |
Product Overview
(2R,3R,4S,5S,6R)-2-(1H-1,2,3-benzotriazol-1-yl)-6-(hydroxymethyl)oxane-3,4,5-triol (CAS 4706-40-5), with molecular formula C12H15N3O5 and molecular weight 281.10 g/mol. IUPAC: (2R,3R,4S,5S,6R)-2-(benzotriazol-1-yl)-6-(hydroxymethyl)oxane-3,4,5-triol.
Chemical Property Profile of (2R,3R,4S,5S,6R)-2-(1H-1,2,3-benzotriazol-1-yl)-6-(hydroxymethyl)oxane-3,4,5-triol
Property Insights of (2R,3R,4S,5S,6R)-2-(1H-1,2,3-benzotriazol-1-yl)-6-(hydroxymethyl)oxane-3,4,5-triol
The XLogP value of -1.5963 indicates that (2R,3R,4S,5S,6R)-2-(1H-1,2,3-benzotriazol-1-yl)-6-(hydroxymethyl)oxane-3,4,5-triol is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 120.86 Ų falls within the moderate polarity range, balancing permeability and solubility for (2R,3R,4S,5S,6R)-2-(1H-1,2,3-benzotriazol-1-yl)-6-(hydroxymethyl)oxane-3,4,5-triol. Following Lipinski's Rule of Five, (2R,3R,4S,5S,6R)-2-(1H-1,2,3-benzotriazol-1-yl)-6-(hydroxymethyl)oxane-3,4,5-triol has 4 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (2R,3R,4S,5S,6R)-2-(1H-1,2,3-benzotriazol-1-yl)-6-(hydroxymethyl)oxane-3,4,5-triol?
The CAS number of (2R,3R,4S,5S,6R)-2-(1H-1,2,3-benzotriazol-1-yl)-6-(hydroxymethyl)oxane-3,4,5-triol is 4706-40-5.
What is the molecular formula of (2R,3R,4S,5S,6R)-2-(1H-1,2,3-benzotriazol-1-yl)-6-(hydroxymethyl)oxane-3,4,5-triol?
The molecular formula of (2R,3R,4S,5S,6R)-2-(1H-1,2,3-benzotriazol-1-yl)-6-(hydroxymethyl)oxane-3,4,5-triol is C12H15N3O5.
What is the molecular weight of (2R,3R,4S,5S,6R)-2-(1H-1,2,3-benzotriazol-1-yl)-6-(hydroxymethyl)oxane-3,4,5-triol?
The molecular weight of (2R,3R,4S,5S,6R)-2-(1H-1,2,3-benzotriazol-1-yl)-6-(hydroxymethyl)oxane-3,4,5-triol is 281.10 g/mol.
Where can I buy (2R,3R,4S,5S,6R)-2-(1H-1,2,3-benzotriazol-1-yl)-6-(hydroxymethyl)oxane-3,4,5-triol?
You can request a quote for (2R,3R,4S,5S,6R)-2-(1H-1,2,3-benzotriazol-1-yl)-6-(hydroxymethyl)oxane-3,4,5-triol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2R,3R,4S,5S,6R)-2-(1H-1,2,3-benzotriazol-1-yl)-6-(hydroxymethyl)oxane-3,4,5-triol?
Yes, KEHONG BIO provides custom synthesis services for (2R,3R,4S,5S,6R)-2-(1H-1,2,3-benzotriazol-1-yl)-6-(hydroxymethyl)oxane-3,4,5-triol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.