Methyl 2-deoxy-3,4-bis-o-(4-nitrobenzoyl)pentopyranoside
TL;DR: Methyl 2-deoxy-3,4-bis-o-(4-nitrobenzoyl)pentopyranoside (CAS 20535-30-2) is a chemical compound with molecular formula C20H18N2O10 and molecular weight 446.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-methoxy-5-(4-nitrobenzoyl)oxyoxan-4-yl] 4-nitrobenzoate
Also Known As: methyl 2-deoxy-3,4-bis-o-(4-nitrobenzoyl)pentopyranoside, [2-methoxy-5-(4-nitrobenzoyl)oxyoxan-4-yl] 4-nitrobenzoate
| Molecular Formula | C20H18N2O10 |
|---|---|
| Molecular Weight | 446.10 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 163.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 7 |
| Exact Mass | 446.09613 |
| Heavy Atoms | 32 |
| Complexity | 689.0 |
Chemical Identifiers
| CAS Number | 20535-30-2 |
|---|---|
| SMILES | COC1CC(C(CO1)OC(=O)C2=CC=C(C=C2)[N+](=O)[O-])OC(=O)C3=CC=C(C=C3)[N+](=O)[O-] |
| InChIKey | DWYWYUISCFNJMR-UHFFFAOYSA-N |
Product Overview
Methyl 2-deoxy-3,4-bis-o-(4-nitrobenzoyl)pentopyranoside (CAS 20535-30-2), with molecular formula C20H18N2O10 and molecular weight 446.10 g/mol. IUPAC: [2-methoxy-5-(4-nitrobenzoyl)oxyoxan-4-yl] 4-nitrobenzoate.
Chemical Property Profile of Methyl 2-deoxy-3,4-bis-o-(4-nitrobenzoyl)pentopyranoside
Property Insights of Methyl 2-deoxy-3,4-bis-o-(4-nitrobenzoyl)pentopyranoside
The XLogP value of 3.1 indicates that Methyl 2-deoxy-3,4-bis-o-(4-nitrobenzoyl)pentopyranoside is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 163.0 Ų indicates high polarity, suggesting Methyl 2-deoxy-3,4-bis-o-(4-nitrobenzoyl)pentopyranoside may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Methyl 2-deoxy-3,4-bis-o-(4-nitrobenzoyl)pentopyranoside has 0 hydrogen bond donor(s) and 10 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 Methyl 2-deoxy-3,4-bis-o-(4-nitrobenzoyl)pentopyranoside?
The CAS number of Methyl 2-deoxy-3,4-bis-o-(4-nitrobenzoyl)pentopyranoside is 20535-30-2.
What is the molecular formula of Methyl 2-deoxy-3,4-bis-o-(4-nitrobenzoyl)pentopyranoside?
The molecular formula of Methyl 2-deoxy-3,4-bis-o-(4-nitrobenzoyl)pentopyranoside is C20H18N2O10.
What is the molecular weight of Methyl 2-deoxy-3,4-bis-o-(4-nitrobenzoyl)pentopyranoside?
The molecular weight of Methyl 2-deoxy-3,4-bis-o-(4-nitrobenzoyl)pentopyranoside is 446.10 g/mol.
Where can I buy Methyl 2-deoxy-3,4-bis-o-(4-nitrobenzoyl)pentopyranoside?
You can request a quote for Methyl 2-deoxy-3,4-bis-o-(4-nitrobenzoyl)pentopyranoside directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2-deoxy-3,4-bis-o-(4-nitrobenzoyl)pentopyranoside?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-deoxy-3,4-bis-o-(4-nitrobenzoyl)pentopyranoside and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.