2,3,5-Tris-o-(4-nitrobenzoyl)-4-thiopentofuranosyl bromide
TL;DR: 2,3,5-Tris-o-(4-nitrobenzoyl)-4-thiopentofuranosyl bromide (CAS 25101-47-7) is a chemical compound with molecular formula C26H18BrN3O12S and molecular weight 674.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[5-bromo-3,4-bis[(4-nitrobenzoyl)oxy]thiolan-2-yl]methyl 4-nitrobenzoate
Also Known As: 2,3,5-tris-o-(4-nitrobenzoyl)-4-thiopentofuranosyl bromide, [5-bromo-3,4-bis[(4-nitrobenzoyl)oxy]thiolan-2-yl]methyl 4-nitrobenzoate
| Molecular Formula | C26H18BrN3O12S |
|---|---|
| Molecular Weight | 674.98 g/mol |
| LogP | 5.9 |
| Topological Polar Surface Area | 242.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 10 |
| Exact Mass | 674.97943 |
| Heavy Atoms | 43 |
| Complexity | 1060.0 |
Chemical Identifiers
| CAS Number | 25101-47-7 |
|---|---|
| SMILES | C1=CC(=CC=C1C(=O)OCC2C(C(C(S2)Br)OC(=O)C3=CC=C(C=C3)[N+](=O)[O-])OC(=O)C4=CC=C(C=C4)[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | ALVIEEFOJRTICK-UHFFFAOYSA-N |
Product Overview
2,3,5-Tris-o-(4-nitrobenzoyl)-4-thiopentofuranosyl bromide (CAS 25101-47-7), with molecular formula C26H18BrN3O12S and molecular weight 674.98 g/mol. IUPAC: [5-bromo-3,4-bis[(4-nitrobenzoyl)oxy]thiolan-2-yl]methyl 4-nitrobenzoate.
Chemical Property Profile of 2,3,5-Tris-o-(4-nitrobenzoyl)-4-thiopentofuranosyl bromide
Property Insights of 2,3,5-Tris-o-(4-nitrobenzoyl)-4-thiopentofuranosyl bromide
The XLogP value of 5.9 indicates that 2,3,5-Tris-o-(4-nitrobenzoyl)-4-thiopentofuranosyl bromide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 242.0 Ų indicates high polarity, suggesting 2,3,5-Tris-o-(4-nitrobenzoyl)-4-thiopentofuranosyl bromide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2,3,5-Tris-o-(4-nitrobenzoyl)-4-thiopentofuranosyl bromide has 0 hydrogen bond donor(s) and 13 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2,3,5-Tris-o-(4-nitrobenzoyl)-4-thiopentofuranosyl bromide?
The CAS number of 2,3,5-Tris-o-(4-nitrobenzoyl)-4-thiopentofuranosyl bromide is 25101-47-7.
What is the molecular formula of 2,3,5-Tris-o-(4-nitrobenzoyl)-4-thiopentofuranosyl bromide?
The molecular formula of 2,3,5-Tris-o-(4-nitrobenzoyl)-4-thiopentofuranosyl bromide is C26H18BrN3O12S.
What is the molecular weight of 2,3,5-Tris-o-(4-nitrobenzoyl)-4-thiopentofuranosyl bromide?
The molecular weight of 2,3,5-Tris-o-(4-nitrobenzoyl)-4-thiopentofuranosyl bromide is 674.98 g/mol.
Where can I buy 2,3,5-Tris-o-(4-nitrobenzoyl)-4-thiopentofuranosyl bromide?
You can request a quote for 2,3,5-Tris-o-(4-nitrobenzoyl)-4-thiopentofuranosyl bromide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,3,5-Tris-o-(4-nitrobenzoyl)-4-thiopentofuranosyl bromide?
Yes, KEHONG BIO provides custom synthesis services for 2,3,5-Tris-o-(4-nitrobenzoyl)-4-thiopentofuranosyl bromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.