Guanosine,2',3',5'-tris(4-chlorobenzoate)
TL;DR: Guanosine,2',3',5'-tris(4-chlorobenzoate) (CAS 42558-86-1) is a chemical compound with molecular formula C31H22Cl3N5O7S and molecular weight 713.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[5-(2-amino-6-sulfanylidene-3H-purin-9-yl)-3,4-bis[(4-chlorobenzoyl)oxy]oxolan-2-yl]methyl 4-chlorobenzoate
Also Known As: KC 1259, Guanosine,2',3',5'-tris(4-chlorobenzoate), 9H-Purine-6-thiol, 2',3',5'-tris(p-chlorobenzoate), Guanosine, 6-thio-,2',3',5'-tris(4-chlorobenzoate), 2-Amino-9-[2,3,5-tris-O-(4-chlorobenzoyl)pentofuranosyl]-3,9-dihydro-6H-purine-6-thione
| Molecular Formula | C31H22Cl3N5O7S |
|---|---|
| Molecular Weight | 713.03 g/mol |
| LogP | 6.23689 |
| Topological Polar Surface Area | 160.65 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 8 |
| Exact Mass | 713.0306 |
| Heavy Atoms | 47 |
| Complexity | 2021.172 |
Chemical Identifiers
| CAS Number | 42558-86-1 |
|---|---|
| SMILES | C1=CC(=CC=C1C(=O)OCC2C(C(C(O2)N3C=NC4=C3NC(=NC4=S)N)OC(=O)C5=CC=C(C=C5)Cl)OC(=O)C6=CC=C(C=C6)Cl)Cl |
Product Overview
Guanosine,2',3',5'-tris(4-chlorobenzoate) (CAS 42558-86-1), with molecular formula C31H22Cl3N5O7S and molecular weight 713.03 g/mol. IUPAC: [5-(2-amino-6-sulfanylidene-3H-purin-9-yl)-3,4-bis[(4-chlorobenzoyl)oxy]oxolan-2-yl]methyl 4-chlorobenzoate.
Chemical Property Profile of Guanosine,2',3',5'-tris(4-chlorobenzoate)
Property Insights of Guanosine,2',3',5'-tris(4-chlorobenzoate)
The XLogP value of 6.23689 indicates that Guanosine,2',3',5'-tris(4-chlorobenzoate) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 160.65 Ų indicates high polarity, suggesting Guanosine,2',3',5'-tris(4-chlorobenzoate) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Guanosine,2',3',5'-tris(4-chlorobenzoate) 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 Guanosine,2',3',5'-tris(4-chlorobenzoate)?
The CAS number of Guanosine,2',3',5'-tris(4-chlorobenzoate) is 42558-86-1.
What is the molecular formula of Guanosine,2',3',5'-tris(4-chlorobenzoate)?
The molecular formula of Guanosine,2',3',5'-tris(4-chlorobenzoate) is C31H22Cl3N5O7S.
What is the molecular weight of Guanosine,2',3',5'-tris(4-chlorobenzoate)?
The molecular weight of Guanosine,2',3',5'-tris(4-chlorobenzoate) is 713.03 g/mol.
Where can I buy Guanosine,2',3',5'-tris(4-chlorobenzoate)?
You can request a quote for Guanosine,2',3',5'-tris(4-chlorobenzoate) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Guanosine,2',3',5'-tris(4-chlorobenzoate)?
Yes, KEHONG BIO provides custom synthesis services for Guanosine,2',3',5'-tris(4-chlorobenzoate) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.