9-(3-s-Benzyl-3-thio-5-o-tritylpentofuranosyl)-n-trityl-9h-purin-6-amine
TL;DR: 9-(3-s-Benzyl-3-thio-5-o-tritylpentofuranosyl)-n-trityl-9h-purin-6-amine (CAS 13304-28-4) is a chemical compound with molecular formula C55H47N5O3S and molecular weight 857.34 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-benzylsulfanyl-2-[6-(tritylamino)purin-9-yl]-5-(trityloxymethyl)oxolan-3-ol
Also Known As: 9-(3-s-benzyl-3-thio-5-o-tritylpentofuranosyl)-n-trityl-9h-purin-6-amine, 4-benzylsulfanyl-2-[6-(tritylamino)purin-9-yl]-5-(trityloxymethyl)oxolan-3-ol, 9-[3-S-Benzyl-3-thio-5-O-(triphenylmethyl)pentofuranosyl]-N-(triphenylmethyl)-9H-purin-6-amine
| Molecular Formula | C55H47N5O3S |
|---|---|
| Molecular Weight | 857.34 g/mol |
| LogP | 11.0 |
| Topological Polar Surface Area | 120.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 15 |
| Exact Mass | 857.33997 |
| Heavy Atoms | 64 |
| Complexity | 1290.0 |
Chemical Identifiers
| CAS Number | 13304-28-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)CSC2C(OC(C2O)N3C=NC4=C(N=CN=C43)NC(C5=CC=CC=C5)(C6=CC=CC=C6)C7=CC=CC=C7)COC(C8=CC=CC=C8)(C9=CC=CC=C9)C1=CC=CC=C1 |
| InChIKey | NYBZLJIVKFVPLD-UHFFFAOYSA-N |
Product Overview
9-(3-s-Benzyl-3-thio-5-o-tritylpentofuranosyl)-n-trityl-9h-purin-6-amine (CAS 13304-28-4), with molecular formula C55H47N5O3S and molecular weight 857.34 g/mol. IUPAC: 4-benzylsulfanyl-2-[6-(tritylamino)purin-9-yl]-5-(trityloxymethyl)oxolan-3-ol.
Chemical Property Profile of 9-(3-s-Benzyl-3-thio-5-o-tritylpentofuranosyl)-n-trityl-9h-purin-6-amine
Property Insights of 9-(3-s-Benzyl-3-thio-5-o-tritylpentofuranosyl)-n-trityl-9h-purin-6-amine
The XLogP value of 11.0 indicates that 9-(3-s-Benzyl-3-thio-5-o-tritylpentofuranosyl)-n-trityl-9h-purin-6-amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 120.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 9-(3-s-Benzyl-3-thio-5-o-tritylpentofuranosyl)-n-trityl-9h-purin-6-amine. Following Lipinski's Rule of Five, 9-(3-s-Benzyl-3-thio-5-o-tritylpentofuranosyl)-n-trityl-9h-purin-6-amine has 2 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 9-(3-s-Benzyl-3-thio-5-o-tritylpentofuranosyl)-n-trityl-9h-purin-6-amine?
The CAS number of 9-(3-s-Benzyl-3-thio-5-o-tritylpentofuranosyl)-n-trityl-9h-purin-6-amine is 13304-28-4.
What is the molecular formula of 9-(3-s-Benzyl-3-thio-5-o-tritylpentofuranosyl)-n-trityl-9h-purin-6-amine?
The molecular formula of 9-(3-s-Benzyl-3-thio-5-o-tritylpentofuranosyl)-n-trityl-9h-purin-6-amine is C55H47N5O3S.
What is the molecular weight of 9-(3-s-Benzyl-3-thio-5-o-tritylpentofuranosyl)-n-trityl-9h-purin-6-amine?
The molecular weight of 9-(3-s-Benzyl-3-thio-5-o-tritylpentofuranosyl)-n-trityl-9h-purin-6-amine is 857.34 g/mol.
Where can I buy 9-(3-s-Benzyl-3-thio-5-o-tritylpentofuranosyl)-n-trityl-9h-purin-6-amine?
You can request a quote for 9-(3-s-Benzyl-3-thio-5-o-tritylpentofuranosyl)-n-trityl-9h-purin-6-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9-(3-s-Benzyl-3-thio-5-o-tritylpentofuranosyl)-n-trityl-9h-purin-6-amine?
Yes, KEHONG BIO provides custom synthesis services for 9-(3-s-Benzyl-3-thio-5-o-tritylpentofuranosyl)-n-trityl-9h-purin-6-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.