2-(Hydroxymethyl)-5-[6-[(4-nitrophenyl)methyl]purin-9-yl]oxolane-3,4-diol
TL;DR: 2-(Hydroxymethyl)-5-[6-[(4-nitrophenyl)methyl]purin-9-yl]oxolane-3,4-diol (CAS 65199-01-1) is a chemical compound with molecular formula C17H17N5O6 and molecular weight 387.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(hydroxymethyl)-5-[6-[(4-nitrophenyl)methyl]purin-9-yl]oxolane-3,4-diol
Also Known As: J3.179.301G, 6-[(4-Nitrophenyl)methyl]-9-pentofuranosyl-9H-purine, 2-(hydroxymethyl)-5-[6-[(4-nitrophenyl)methyl]purin-9-yl]oxolane-3,4-diol, 2-(hydroxymethyl)-5-{6-[(4-nitrophenyl)methyl]-9H-purin-9-yl}oxolane-3,4-diol, 2-[6-(4-Nitrobenzyl)-9H-purine-9-yl]-5-(hydroxymethyl)tetrahydrofuran-3,4-diol
| Molecular Formula | C17H17N5O6 |
|---|---|
| Molecular Weight | 387.12 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 159.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 4 |
| Exact Mass | 387.1179 |
| Heavy Atoms | 28 |
| Complexity | 557.0 |
Chemical Identifiers
| CAS Number | 65199-01-1 |
|---|---|
| SMILES | C1=CC(=CC=C1CC2=C3C(=NC=N2)N(C=N3)C4C(C(C(O4)CO)O)O)[N+](=O)[O-] |
| InChIKey | JDVXMOKFIDYPPV-UHFFFAOYSA-N |
Product Overview
2-(Hydroxymethyl)-5-[6-[(4-nitrophenyl)methyl]purin-9-yl]oxolane-3,4-diol (CAS 65199-01-1), with molecular formula C17H17N5O6 and molecular weight 387.12 g/mol. IUPAC: 2-(hydroxymethyl)-5-[6-[(4-nitrophenyl)methyl]purin-9-yl]oxolane-3,4-diol.
Chemical Property Profile of 2-(Hydroxymethyl)-5-[6-[(4-nitrophenyl)methyl]purin-9-yl]oxolane-3,4-diol
Property Insights of 2-(Hydroxymethyl)-5-[6-[(4-nitrophenyl)methyl]purin-9-yl]oxolane-3,4-diol
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(Hydroxymethyl)-5-[6-[(4-nitrophenyl)methyl]purin-9-yl]oxolane-3,4-diol. The TPSA of 159.0 Ų indicates high polarity, suggesting 2-(Hydroxymethyl)-5-[6-[(4-nitrophenyl)methyl]purin-9-yl]oxolane-3,4-diol may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2-(Hydroxymethyl)-5-[6-[(4-nitrophenyl)methyl]purin-9-yl]oxolane-3,4-diol has 3 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-(Hydroxymethyl)-5-[6-[(4-nitrophenyl)methyl]purin-9-yl]oxolane-3,4-diol?
The CAS number of 2-(Hydroxymethyl)-5-[6-[(4-nitrophenyl)methyl]purin-9-yl]oxolane-3,4-diol is 65199-01-1.
What is the molecular formula of 2-(Hydroxymethyl)-5-[6-[(4-nitrophenyl)methyl]purin-9-yl]oxolane-3,4-diol?
The molecular formula of 2-(Hydroxymethyl)-5-[6-[(4-nitrophenyl)methyl]purin-9-yl]oxolane-3,4-diol is C17H17N5O6.
What is the molecular weight of 2-(Hydroxymethyl)-5-[6-[(4-nitrophenyl)methyl]purin-9-yl]oxolane-3,4-diol?
The molecular weight of 2-(Hydroxymethyl)-5-[6-[(4-nitrophenyl)methyl]purin-9-yl]oxolane-3,4-diol is 387.12 g/mol.
Where can I buy 2-(Hydroxymethyl)-5-[6-[(4-nitrophenyl)methyl]purin-9-yl]oxolane-3,4-diol?
You can request a quote for 2-(Hydroxymethyl)-5-[6-[(4-nitrophenyl)methyl]purin-9-yl]oxolane-3,4-diol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Hydroxymethyl)-5-[6-[(4-nitrophenyl)methyl]purin-9-yl]oxolane-3,4-diol?
Yes, KEHONG BIO provides custom synthesis services for 2-(Hydroxymethyl)-5-[6-[(4-nitrophenyl)methyl]purin-9-yl]oxolane-3,4-diol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.