Methyl 2-deoxy-3,5-bis-O-(4-nitrobenzoyl)pentofuranoside
TL;DR: Methyl 2-deoxy-3,5-bis-O-(4-nitrobenzoyl)pentofuranoside (CAS 52085-24-2) 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.
[5-methoxy-3-(4-nitrobenzoyl)oxyoxolan-2-yl]methyl 4-nitrobenzoate
Also Known As: Methyl 2-deoxy-3,5-bis-O-(4-nitrobenzoyl)pentofuranoside, 2,4(1H,3H)-Pyrimidinedione,1-(3-bromopropyl)-5-butyl, METHYL 2-DEOXY-3,5-DI-O-P-NITROBENZOYL D -RIBOFURANOSIDE, [5-methoxy-3-(4-nitrobenzoyl)oxyoxolan-2-yl]methyl 4-nitrobenzoate, Methyl 2-deoxy-3,5-bis-O-(4-nitrobenzoyl)pentofuranoside #
| 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 | 8 |
| Exact Mass | 446.09613 |
| Heavy Atoms | 32 |
| Complexity | 689.0 |
Chemical Identifiers
| CAS Number | 52085-24-2 |
|---|---|
| SMILES | COC1CC(C(O1)COC(=O)C2=CC=C(C=C2)[N+](=O)[O-])OC(=O)C3=CC=C(C=C3)[N+](=O)[O-] |
| InChIKey | NGKKKFKTIZCIEN-UHFFFAOYSA-N |
Product Overview
Methyl 2-deoxy-3,5-bis-O-(4-nitrobenzoyl)pentofuranoside (CAS 52085-24-2), with molecular formula C20H18N2O10 and molecular weight 446.10 g/mol. IUPAC: [5-methoxy-3-(4-nitrobenzoyl)oxyoxolan-2-yl]methyl 4-nitrobenzoate.
Chemical Property Profile of Methyl 2-deoxy-3,5-bis-O-(4-nitrobenzoyl)pentofuranoside
Property Insights of Methyl 2-deoxy-3,5-bis-O-(4-nitrobenzoyl)pentofuranoside
The XLogP value of 3.1 indicates that Methyl 2-deoxy-3,5-bis-O-(4-nitrobenzoyl)pentofuranoside 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-3,5-bis-O-(4-nitrobenzoyl)pentofuranoside may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Methyl 2-deoxy-3,5-bis-O-(4-nitrobenzoyl)pentofuranoside 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-3,5-bis-O-(4-nitrobenzoyl)pentofuranoside?
The CAS number of Methyl 2-deoxy-3,5-bis-O-(4-nitrobenzoyl)pentofuranoside is 52085-24-2.
What is the molecular formula of Methyl 2-deoxy-3,5-bis-O-(4-nitrobenzoyl)pentofuranoside?
The molecular formula of Methyl 2-deoxy-3,5-bis-O-(4-nitrobenzoyl)pentofuranoside is C20H18N2O10.
What is the molecular weight of Methyl 2-deoxy-3,5-bis-O-(4-nitrobenzoyl)pentofuranoside?
The molecular weight of Methyl 2-deoxy-3,5-bis-O-(4-nitrobenzoyl)pentofuranoside is 446.10 g/mol.
Where can I buy Methyl 2-deoxy-3,5-bis-O-(4-nitrobenzoyl)pentofuranoside?
You can request a quote for Methyl 2-deoxy-3,5-bis-O-(4-nitrobenzoyl)pentofuranoside 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-3,5-bis-O-(4-nitrobenzoyl)pentofuranoside?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-deoxy-3,5-bis-O-(4-nitrobenzoyl)pentofuranoside and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.