1H-Purine-2,6,8(3H)-trione, 7,9-dihydro-1,3,7,9-tetrakis(hydroxymethyl)-
TL;DR: 1H-Purine-2,6,8(3H)-trione, 7,9-dihydro-1,3,7,9-tetrakis(hydroxymethyl)- (CAS 71042-92-7) is a chemical compound with molecular formula C9H12N4O7 and molecular weight 288.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3,7,9-tetrakis(hydroxymethyl)purine-2,6,8-trione
Also Known As: 1,3,7,9-Tetra(hydroxymethyl)-7,9-dihydro-1H-purine-2,6,8(3H)-trione, 1H-Purine-2,6,8(3H)-trione, 7,9-dihydro-1,3,7,9-tetrakis(hydroxymethyl)-, 1,3,7,9-tetrakis(hydroxymethyl)purine-2,6,8-trione, 1,3,7,9-Tetrakis(hydroxymethyl)-7,9-dihydro-1H-purine-2,6,8(3H)-trione, 7,9-Dihydro-1,3,7,9-tetrakis(hydroxymethyl)-1H-purine-2,6,8(3H)-trione
| Molecular Formula | C9H12N4O7 |
|---|---|
| Molecular Weight | 288.07 g/mol |
| LogP | -1.9 |
| Topological Polar Surface Area | 145.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 288.0706 |
| Heavy Atoms | 20 |
| Complexity | 505.0 |
Chemical Identifiers
| CAS Number | 71042-92-7 |
|---|---|
| SMILES | C(N1C2=C(N(C1=O)CO)N(C(=O)N(C2=O)CO)CO)O |
| InChIKey | RLVYQYFDQDDJRH-UHFFFAOYSA-N |
Product Overview
1H-Purine-2,6,8(3H)-trione, 7,9-dihydro-1,3,7,9-tetrakis(hydroxymethyl)- (CAS 71042-92-7), with molecular formula C9H12N4O7 and molecular weight 288.07 g/mol. IUPAC: 1,3,7,9-tetrakis(hydroxymethyl)purine-2,6,8-trione.
Chemical Property Profile of 1H-Purine-2,6,8(3H)-trione, 7,9-dihydro-1,3,7,9-tetrakis(hydroxymethyl)-
Property Insights of 1H-Purine-2,6,8(3H)-trione, 7,9-dihydro-1,3,7,9-tetrakis(hydroxymethyl)-
The XLogP value of -1.9 indicates that 1H-Purine-2,6,8(3H)-trione, 7,9-dihydro-1,3,7,9-tetrakis(hydroxymethyl)- is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 145.0 Ų indicates high polarity, suggesting 1H-Purine-2,6,8(3H)-trione, 7,9-dihydro-1,3,7,9-tetrakis(hydroxymethyl)- may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1H-Purine-2,6,8(3H)-trione, 7,9-dihydro-1,3,7,9-tetrakis(hydroxymethyl)- has 4 hydrogen bond donor(s) and 7 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 1H-Purine-2,6,8(3H)-trione, 7,9-dihydro-1,3,7,9-tetrakis(hydroxymethyl)-?
The CAS number of 1H-Purine-2,6,8(3H)-trione, 7,9-dihydro-1,3,7,9-tetrakis(hydroxymethyl)- is 71042-92-7.
What is the molecular formula of 1H-Purine-2,6,8(3H)-trione, 7,9-dihydro-1,3,7,9-tetrakis(hydroxymethyl)-?
The molecular formula of 1H-Purine-2,6,8(3H)-trione, 7,9-dihydro-1,3,7,9-tetrakis(hydroxymethyl)- is C9H12N4O7.
What is the molecular weight of 1H-Purine-2,6,8(3H)-trione, 7,9-dihydro-1,3,7,9-tetrakis(hydroxymethyl)-?
The molecular weight of 1H-Purine-2,6,8(3H)-trione, 7,9-dihydro-1,3,7,9-tetrakis(hydroxymethyl)- is 288.07 g/mol.
Where can I buy 1H-Purine-2,6,8(3H)-trione, 7,9-dihydro-1,3,7,9-tetrakis(hydroxymethyl)-?
You can request a quote for 1H-Purine-2,6,8(3H)-trione, 7,9-dihydro-1,3,7,9-tetrakis(hydroxymethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Purine-2,6,8(3H)-trione, 7,9-dihydro-1,3,7,9-tetrakis(hydroxymethyl)-?
Yes, KEHONG BIO provides custom synthesis services for 1H-Purine-2,6,8(3H)-trione, 7,9-dihydro-1,3,7,9-tetrakis(hydroxymethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.