6-(2,3,5-tri-o-benzoylpentofuranosyl)[1,3]thiazolo[5,4-d]pyrimidine-5,7(4h,6h)-dione
TL;DR: 6-(2,3,5-tri-o-benzoylpentofuranosyl)[1,3]thiazolo[5,4-d]pyrimidine-5,7(4h,6h)-dione (CAS 55919-47-6) is a chemical compound with molecular formula C31H23N3O9S and molecular weight 613.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3,4-dibenzoyloxy-5-(5,7-dioxo-4H-[1,3]thiazolo[5,4-d]pyrimidin-6-yl)oxolan-2-yl]methyl benzoate
Also Known As: 6-(2,3,5-tri-o-benzoylpentofuranosyl)[1,3]thiazolo[5,4-d]pyrimidine-5,7(4h,6h)-dione, [3,4-dibenzoyloxy-5-(5,7-dioxo-4H-[1,3]thiazolo[5,4-d]pyrimidin-6-yl)oxolan-2-yl]methyl benzoate, 5-Hydroxy-6-(2,3,5-tri-O-benzoylpentofuranosyl)[1,3]thiazolo[5,4-d]pyrimidin-7(6H)-one
| Molecular Formula | C31H23N3O9S |
|---|---|
| Molecular Weight | 613.12 g/mol |
| LogP | 5.0 |
| Topological Polar Surface Area | 179.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 11 |
| Exact Mass | 613.1155 |
| Heavy Atoms | 44 |
| Complexity | 1090.0 |
Chemical Identifiers
| CAS Number | 55919-47-6 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)OCC2C(C(C(O2)N3C(=O)C4=C(NC3=O)SC=N4)OC(=O)C5=CC=CC=C5)OC(=O)C6=CC=CC=C6 |
| InChIKey | IPVAKHIEWGRLSU-UHFFFAOYSA-N |
Product Overview
6-(2,3,5-tri-o-benzoylpentofuranosyl)[1,3]thiazolo[5,4-d]pyrimidine-5,7(4h,6h)-dione (CAS 55919-47-6), with molecular formula C31H23N3O9S and molecular weight 613.12 g/mol. IUPAC: [3,4-dibenzoyloxy-5-(5,7-dioxo-4H-[1,3]thiazolo[5,4-d]pyrimidin-6-yl)oxolan-2-yl]methyl benzoate.
Chemical Property Profile of 6-(2,3,5-tri-o-benzoylpentofuranosyl)[1,3]thiazolo[5,4-d]pyrimidine-5,7(4h,6h)-dione
Property Insights of 6-(2,3,5-tri-o-benzoylpentofuranosyl)[1,3]thiazolo[5,4-d]pyrimidine-5,7(4h,6h)-dione
The XLogP value of 5.0 indicates that 6-(2,3,5-tri-o-benzoylpentofuranosyl)[1,3]thiazolo[5,4-d]pyrimidine-5,7(4h,6h)-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 179.0 Ų indicates high polarity, suggesting 6-(2,3,5-tri-o-benzoylpentofuranosyl)[1,3]thiazolo[5,4-d]pyrimidine-5,7(4h,6h)-dione may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 6-(2,3,5-tri-o-benzoylpentofuranosyl)[1,3]thiazolo[5,4-d]pyrimidine-5,7(4h,6h)-dione has 1 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 6-(2,3,5-tri-o-benzoylpentofuranosyl)[1,3]thiazolo[5,4-d]pyrimidine-5,7(4h,6h)-dione?
The CAS number of 6-(2,3,5-tri-o-benzoylpentofuranosyl)[1,3]thiazolo[5,4-d]pyrimidine-5,7(4h,6h)-dione is 55919-47-6.
What is the molecular formula of 6-(2,3,5-tri-o-benzoylpentofuranosyl)[1,3]thiazolo[5,4-d]pyrimidine-5,7(4h,6h)-dione?
The molecular formula of 6-(2,3,5-tri-o-benzoylpentofuranosyl)[1,3]thiazolo[5,4-d]pyrimidine-5,7(4h,6h)-dione is C31H23N3O9S.
What is the molecular weight of 6-(2,3,5-tri-o-benzoylpentofuranosyl)[1,3]thiazolo[5,4-d]pyrimidine-5,7(4h,6h)-dione?
The molecular weight of 6-(2,3,5-tri-o-benzoylpentofuranosyl)[1,3]thiazolo[5,4-d]pyrimidine-5,7(4h,6h)-dione is 613.12 g/mol.
Where can I buy 6-(2,3,5-tri-o-benzoylpentofuranosyl)[1,3]thiazolo[5,4-d]pyrimidine-5,7(4h,6h)-dione?
You can request a quote for 6-(2,3,5-tri-o-benzoylpentofuranosyl)[1,3]thiazolo[5,4-d]pyrimidine-5,7(4h,6h)-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-(2,3,5-tri-o-benzoylpentofuranosyl)[1,3]thiazolo[5,4-d]pyrimidine-5,7(4h,6h)-dione?
Yes, KEHONG BIO provides custom synthesis services for 6-(2,3,5-tri-o-benzoylpentofuranosyl)[1,3]thiazolo[5,4-d]pyrimidine-5,7(4h,6h)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.