6-[(7H-Purin-6-yl)sulfanyl]-1,2,4-triazine-3,5(2H,4H)-dione
TL;DR: 6-[(7H-Purin-6-yl)sulfanyl]-1,2,4-triazine-3,5(2H,4H)-dione (CAS 6143-37-9) is a chemical compound with molecular formula C8H5N7O2S and molecular weight 263.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(7H-purin-6-ylsulfanyl)-2H-1,2,4-triazine-3,5-dione
Also Known As: SDCCGSBI-0660729.P001, AB00682026-01, 6-(9H-purin-6-ylthio)-1,2,4-triazine-3,5(2H,4H)-dione, 6-(7H-purin-6-ylsulfanyl)-2H-1,2,4-triazine-3,5-dione, 6-[(7H-Purin-6-yl)sulfanyl]-1,2,4-triazine-3,5(2H,4H)-dione
| Molecular Formula | C8H5N7O2S |
|---|---|
| Molecular Weight | 263.02 g/mol |
| LogP | -0.7243 |
| Topological Polar Surface Area | 133.07 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 263.02255 |
| Heavy Atoms | 18 |
| Complexity | 819.6687 |
Chemical Identifiers
| CAS Number | 6143-37-9 |
|---|---|
| SMILES | C1=NC2=C(N1)C(=NC=N2)SC3=NNC(=O)NC3=O |
Product Overview
6-[(7H-Purin-6-yl)sulfanyl]-1,2,4-triazine-3,5(2H,4H)-dione (CAS 6143-37-9), with molecular formula C8H5N7O2S and molecular weight 263.02 g/mol. IUPAC: 6-(7H-purin-6-ylsulfanyl)-2H-1,2,4-triazine-3,5-dione.
Chemical Property Profile of 6-[(7H-Purin-6-yl)sulfanyl]-1,2,4-triazine-3,5(2H,4H)-dione
Property Insights of 6-[(7H-Purin-6-yl)sulfanyl]-1,2,4-triazine-3,5(2H,4H)-dione
The XLogP value of -0.7243 indicates that 6-[(7H-Purin-6-yl)sulfanyl]-1,2,4-triazine-3,5(2H,4H)-dione is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 133.07 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-[(7H-Purin-6-yl)sulfanyl]-1,2,4-triazine-3,5(2H,4H)-dione. Following Lipinski's Rule of Five, 6-[(7H-Purin-6-yl)sulfanyl]-1,2,4-triazine-3,5(2H,4H)-dione has 3 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 6-[(7H-Purin-6-yl)sulfanyl]-1,2,4-triazine-3,5(2H,4H)-dione?
The CAS number of 6-[(7H-Purin-6-yl)sulfanyl]-1,2,4-triazine-3,5(2H,4H)-dione is 6143-37-9.
What is the molecular formula of 6-[(7H-Purin-6-yl)sulfanyl]-1,2,4-triazine-3,5(2H,4H)-dione?
The molecular formula of 6-[(7H-Purin-6-yl)sulfanyl]-1,2,4-triazine-3,5(2H,4H)-dione is C8H5N7O2S.
What is the molecular weight of 6-[(7H-Purin-6-yl)sulfanyl]-1,2,4-triazine-3,5(2H,4H)-dione?
The molecular weight of 6-[(7H-Purin-6-yl)sulfanyl]-1,2,4-triazine-3,5(2H,4H)-dione is 263.02 g/mol.
Where can I buy 6-[(7H-Purin-6-yl)sulfanyl]-1,2,4-triazine-3,5(2H,4H)-dione?
You can request a quote for 6-[(7H-Purin-6-yl)sulfanyl]-1,2,4-triazine-3,5(2H,4H)-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-[(7H-Purin-6-yl)sulfanyl]-1,2,4-triazine-3,5(2H,4H)-dione?
Yes, KEHONG BIO provides custom synthesis services for 6-[(7H-Purin-6-yl)sulfanyl]-1,2,4-triazine-3,5(2H,4H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.