peroxy Y nucleoside
TL;DR: peroxy Y nucleoside (CAS 78355-49-4) is a chemical compound with molecular formula C21H28N6O11 and molecular weight 540.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-[3-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-4,6-dimethyl-9-oxoimidazo[1,2-a]purin-7-yl]-3-hydroperoxy-2-(methoxycarbonylamino)butanoate
Also Known As: Peroxy Y nucleoside, J1.893.374H, methyl 4-[3-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-4,6-dimethyl-9-oxoimidazo[1,2-a]purin-7-yl]-3-hydroperoxy-2-(methoxycarbonylamino)butanoate, 3H-Imidazo(1,2-a)purine-7-butanoic acid, 4,9-dihydro-beta-hydroperoxy-alpha-((methoxycarbonyl)amino)-4,6-dimethyl-9-oxo-3-beta-D-ribofuranosyl-, methyl ester, 2-(Methoxycarbonylamino)-3-hydroperoxy-4-[3-(beta-D-ribofuranosyl)-4,6-dimethyl-9-oxo-4,9-dihydro-3H-imidazo[1,2-a]purine-7-yl]butyric acid methyl ester
| Molecular Formula | C21H28N6O11 |
|---|---|
| Molecular Weight | 540.18 g/mol |
| LogP | -1.4 |
| Topological Polar Surface Area | 220.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 14 |
| Rotatable Bonds | 10 |
| Exact Mass | 540.1816 |
| Heavy Atoms | 38 |
| Complexity | 900.0 |
Chemical Identifiers
| CAS Number | 78355-49-4 |
|---|---|
| SMILES | CC1=C(N2C(=O)C3=C(N(C2=N1)C)N(C=N3)[C@H]4[C@@H]([C@@H]([C@H](O4)CO)O)O)CC(C(C(=O)OC)NC(=O)OC)OO |
| InChIKey | WCNMEQDMUYVWMJ-HSRLSWODSA-N |
Product Overview
peroxy Y nucleoside (CAS 78355-49-4), with molecular formula C21H28N6O11 and molecular weight 540.18 g/mol. IUPAC: methyl 4-[3-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-4,6-dimethyl-9-oxoimidazo[1,2-a]purin-7-yl]-3-hydroperoxy-2-(methoxycarbonylamino)butanoate.
Chemical Property Profile of peroxy Y nucleoside
Property Insights of peroxy Y nucleoside
The XLogP value of -1.4 indicates that peroxy Y nucleoside is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 220.0 Ų indicates high polarity, suggesting peroxy Y nucleoside may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, peroxy Y nucleoside has 5 hydrogen bond donor(s) and 14 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of peroxy Y nucleoside?
The CAS number of peroxy Y nucleoside is 78355-49-4.
What is the molecular formula of peroxy Y nucleoside?
The molecular formula of peroxy Y nucleoside is C21H28N6O11.
What is the molecular weight of peroxy Y nucleoside?
The molecular weight of peroxy Y nucleoside is 540.18 g/mol.
Where can I buy peroxy Y nucleoside?
You can request a quote for peroxy Y nucleoside directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for peroxy Y nucleoside?
Yes, KEHONG BIO provides custom synthesis services for peroxy Y nucleoside and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.