1,5,7,8-Tetrahydro-2,4,6(3H)-pteridinetrione
TL;DR: 1,5,7,8-Tetrahydro-2,4,6(3H)-pteridinetrione (CAS 35045-67-1) is a chemical compound with molecular formula C6H6N4O3 and molecular weight 182.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,5,7,8-tetrahydropteridine-2,4,6-trione
Also Known As: 7,8-Dihydro-6-hydroxylumazine, 1,5,7,8-tetrahydropteridine-2,4,6-trione, 2,4,6(3H)-Pteridinetrione, 1,5,7,8-tetrahydro-, 2,4,6(3H)-Pteridinetrione,1,5,7,8-tetrahydro-, 1,5,7,8-Tetrahydro-2,4,6(3H)-pteridinetrione
| Molecular Formula | C6H6N4O3 |
|---|---|
| Molecular Weight | 182.04 g/mol |
| LogP | -1.6 |
| Topological Polar Surface Area | 99.3 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 182.04399 |
| Heavy Atoms | 13 |
| Complexity | 346.0 |
Chemical Identifiers
| CAS Number | 35045-67-1 |
|---|---|
| SMILES | C1C(=O)NC2=C(N1)NC(=O)NC2=O |
| InChIKey | XBQISFWWQWPDSV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,5,7,8-Tetrahydro-2,4,6(3H)-pteridinetrione (CAS 35045-67-1), with molecular formula C6H6N4O3 and molecular weight 182.04 g/mol. IUPAC: 1,5,7,8-tetrahydropteridine-2,4,6-trione.
Chemical Property Profile of 1,5,7,8-Tetrahydro-2,4,6(3H)-pteridinetrione
Property Insights of 1,5,7,8-Tetrahydro-2,4,6(3H)-pteridinetrione
The XLogP value of -1.6 indicates that 1,5,7,8-Tetrahydro-2,4,6(3H)-pteridinetrione is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 99.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,5,7,8-Tetrahydro-2,4,6(3H)-pteridinetrione. Following Lipinski's Rule of Five, 1,5,7,8-Tetrahydro-2,4,6(3H)-pteridinetrione has 4 hydrogen bond donor(s) and 4 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 1,5,7,8-Tetrahydro-2,4,6(3H)-pteridinetrione?
The CAS number of 1,5,7,8-Tetrahydro-2,4,6(3H)-pteridinetrione is 35045-67-1.
What is the molecular formula of 1,5,7,8-Tetrahydro-2,4,6(3H)-pteridinetrione?
The molecular formula of 1,5,7,8-Tetrahydro-2,4,6(3H)-pteridinetrione is C6H6N4O3.
What is the molecular weight of 1,5,7,8-Tetrahydro-2,4,6(3H)-pteridinetrione?
The molecular weight of 1,5,7,8-Tetrahydro-2,4,6(3H)-pteridinetrione is 182.04 g/mol.
Where can I buy 1,5,7,8-Tetrahydro-2,4,6(3H)-pteridinetrione?
You can request a quote for 1,5,7,8-Tetrahydro-2,4,6(3H)-pteridinetrione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,5,7,8-Tetrahydro-2,4,6(3H)-pteridinetrione?
Yes, KEHONG BIO provides custom synthesis services for 1,5,7,8-Tetrahydro-2,4,6(3H)-pteridinetrione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.