![methyl 2-o-[(4-methylphenyl)sulfonyl]-3-o-(4-nitrobenzoyl)hexopyranoside structure](/static/products/2093/20934-69-4.webp)
methyl 2-o-[(4-methylphenyl)sulfonyl]-3-o-(4-nitrobenzoyl)hexopyranoside
TL;DR: methyl 2-o-[(4-methylphenyl)sulfonyl]-3-o-(4-nitrobenzoyl)hexopyranoside (CAS 20934-69-4) is a chemical compound with molecular formula C21H23NO11S and molecular weight 497.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-hydroxy-2-(hydroxymethyl)-6-methoxy-5-(4-methylphenyl)sulfonyloxyoxan-4-yl] 4-nitrobenzoate
Also Known As: methyl 2-o-[(4-methylphenyl)sulfonyl]-3-o-(4-nitrobenzoyl)hexopyranoside, [3-hydroxy-2-(hydroxymethyl)-6-methoxy-5-(4-methylphenyl)sulfonyloxyoxan-4-yl] 4-nitrobenzoate, Methyl 2-O-(4-methylbenzene-1-sulfonyl)-3-O-(4-nitrobenzoyl)hexopyranoside
| Molecular Formula | C21H23NO11S |
|---|---|
| Molecular Weight | 497.10 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 183.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 8 |
| Exact Mass | 497.09918 |
| Heavy Atoms | 34 |
| Complexity | 795.0 |
Chemical Identifiers
| CAS Number | 20934-69-4 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)OC2C(C(C(OC2OC)CO)O)OC(=O)C3=CC=C(C=C3)[N+](=O)[O-] |
| InChIKey | HNHPFZJATYETFS-UHFFFAOYSA-N |
Product Overview
methyl 2-o-[(4-methylphenyl)sulfonyl]-3-o-(4-nitrobenzoyl)hexopyranoside (CAS 20934-69-4), with molecular formula C21H23NO11S and molecular weight 497.10 g/mol. IUPAC: [3-hydroxy-2-(hydroxymethyl)-6-methoxy-5-(4-methylphenyl)sulfonyloxyoxan-4-yl] 4-nitrobenzoate.
Chemical Property Profile of methyl 2-o-[(4-methylphenyl)sulfonyl]-3-o-(4-nitrobenzoyl)hexopyranoside
Property Insights of methyl 2-o-[(4-methylphenyl)sulfonyl]-3-o-(4-nitrobenzoyl)hexopyranoside
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl 2-o-[(4-methylphenyl)sulfonyl]-3-o-(4-nitrobenzoyl)hexopyranoside. The TPSA of 183.0 Ų indicates high polarity, suggesting methyl 2-o-[(4-methylphenyl)sulfonyl]-3-o-(4-nitrobenzoyl)hexopyranoside may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, methyl 2-o-[(4-methylphenyl)sulfonyl]-3-o-(4-nitrobenzoyl)hexopyranoside has 2 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of methyl 2-o-[(4-methylphenyl)sulfonyl]-3-o-(4-nitrobenzoyl)hexopyranoside?
The CAS number of methyl 2-o-[(4-methylphenyl)sulfonyl]-3-o-(4-nitrobenzoyl)hexopyranoside is 20934-69-4.
What is the molecular formula of methyl 2-o-[(4-methylphenyl)sulfonyl]-3-o-(4-nitrobenzoyl)hexopyranoside?
The molecular formula of methyl 2-o-[(4-methylphenyl)sulfonyl]-3-o-(4-nitrobenzoyl)hexopyranoside is C21H23NO11S.
What is the molecular weight of methyl 2-o-[(4-methylphenyl)sulfonyl]-3-o-(4-nitrobenzoyl)hexopyranoside?
The molecular weight of methyl 2-o-[(4-methylphenyl)sulfonyl]-3-o-(4-nitrobenzoyl)hexopyranoside is 497.10 g/mol.
Where can I buy methyl 2-o-[(4-methylphenyl)sulfonyl]-3-o-(4-nitrobenzoyl)hexopyranoside?
You can request a quote for methyl 2-o-[(4-methylphenyl)sulfonyl]-3-o-(4-nitrobenzoyl)hexopyranoside directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl 2-o-[(4-methylphenyl)sulfonyl]-3-o-(4-nitrobenzoyl)hexopyranoside?
Yes, KEHONG BIO provides custom synthesis services for methyl 2-o-[(4-methylphenyl)sulfonyl]-3-o-(4-nitrobenzoyl)hexopyranoside and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.