1,3-Dimethyl-2-thioxo-1,2,3,5-tetrahydro-4,6-pteridinedione
TL;DR: 1,3-Dimethyl-2-thioxo-1,2,3,5-tetrahydro-4,6-pteridinedione (CAS 343347-29-5) is a chemical compound with molecular formula C8H8N4O2S and molecular weight 224.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-dimethyl-2-sulfanylidene-5H-pteridine-4,6-dione
Also Known As: 1,3-dimethyl-2-thioxo-1,2,3,5-tetrahydro-4,6-pteridinedione, 1,3-dimethyl-2-sulfanylidene-5H-pteridine-4,6-dione, AB-323/13887265
| Molecular Formula | C8H8N4O2S |
|---|---|
| Molecular Weight | 224.04 g/mol |
| LogP | -0.31021 |
| Topological Polar Surface Area | 72.68 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 224.0368 |
| Heavy Atoms | 15 |
| Complexity | 709.12415 |
Chemical Identifiers
| CAS Number | 343347-29-5 |
|---|---|
| SMILES | CN1C2=C(C(=O)N(C1=S)C)NC(=O)C=N2 |
Product Overview
1,3-Dimethyl-2-thioxo-1,2,3,5-tetrahydro-4,6-pteridinedione (CAS 343347-29-5), with molecular formula C8H8N4O2S and molecular weight 224.04 g/mol. IUPAC: 1,3-dimethyl-2-sulfanylidene-5H-pteridine-4,6-dione.
Chemical Property Profile of 1,3-Dimethyl-2-thioxo-1,2,3,5-tetrahydro-4,6-pteridinedione
Property Insights of 1,3-Dimethyl-2-thioxo-1,2,3,5-tetrahydro-4,6-pteridinedione
The XLogP value of -0.31021 indicates that 1,3-Dimethyl-2-thioxo-1,2,3,5-tetrahydro-4,6-pteridinedione is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 72.68 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3-Dimethyl-2-thioxo-1,2,3,5-tetrahydro-4,6-pteridinedione. Following Lipinski's Rule of Five, 1,3-Dimethyl-2-thioxo-1,2,3,5-tetrahydro-4,6-pteridinedione has 1 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 1,3-Dimethyl-2-thioxo-1,2,3,5-tetrahydro-4,6-pteridinedione?
The CAS number of 1,3-Dimethyl-2-thioxo-1,2,3,5-tetrahydro-4,6-pteridinedione is 343347-29-5.
What is the molecular formula of 1,3-Dimethyl-2-thioxo-1,2,3,5-tetrahydro-4,6-pteridinedione?
The molecular formula of 1,3-Dimethyl-2-thioxo-1,2,3,5-tetrahydro-4,6-pteridinedione is C8H8N4O2S.
What is the molecular weight of 1,3-Dimethyl-2-thioxo-1,2,3,5-tetrahydro-4,6-pteridinedione?
The molecular weight of 1,3-Dimethyl-2-thioxo-1,2,3,5-tetrahydro-4,6-pteridinedione is 224.04 g/mol.
Where can I buy 1,3-Dimethyl-2-thioxo-1,2,3,5-tetrahydro-4,6-pteridinedione?
You can request a quote for 1,3-Dimethyl-2-thioxo-1,2,3,5-tetrahydro-4,6-pteridinedione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Dimethyl-2-thioxo-1,2,3,5-tetrahydro-4,6-pteridinedione?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Dimethyl-2-thioxo-1,2,3,5-tetrahydro-4,6-pteridinedione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.