3-methyl-2-thioxo-2,3-dihydro-4,7(1H,8H)-pteridinedione
TL;DR: 3-methyl-2-thioxo-2,3-dihydro-4,7(1H,8H)-pteridinedione (CAS 70673-78-8) is a chemical compound with molecular formula C7H6N4O2S and molecular weight 210.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyl-2-sulfanylidene-1,8-dihydropteridine-4,7-dione
Also Known As: 3-methyl-2-thioxo-2,3-dihydro-4,7(1H,8H)-pteridinedione, AB-323/13887205, 3-methyl-2-sulfanylidene-1,8-dihydropteridine-4,7-dione
| Molecular Formula | C7H6N4O2S |
|---|---|
| Molecular Weight | 210.02 g/mol |
| LogP | -0.32061 |
| Topological Polar Surface Area | 83.54 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 210.02115 |
| Heavy Atoms | 14 |
| Complexity | 665.66974 |
Chemical Identifiers
| CAS Number | 70673-78-8 |
|---|---|
| SMILES | CN1C(=O)C2=C(NC(=O)C=N2)NC1=S |
Product Overview
3-methyl-2-thioxo-2,3-dihydro-4,7(1H,8H)-pteridinedione (CAS 70673-78-8), with molecular formula C7H6N4O2S and molecular weight 210.02 g/mol. IUPAC: 3-methyl-2-sulfanylidene-1,8-dihydropteridine-4,7-dione.
Chemical Property Profile of 3-methyl-2-thioxo-2,3-dihydro-4,7(1H,8H)-pteridinedione
Property Insights of 3-methyl-2-thioxo-2,3-dihydro-4,7(1H,8H)-pteridinedione
The XLogP value of -0.32061 indicates that 3-methyl-2-thioxo-2,3-dihydro-4,7(1H,8H)-pteridinedione is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 83.54 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-methyl-2-thioxo-2,3-dihydro-4,7(1H,8H)-pteridinedione. Following Lipinski's Rule of Five, 3-methyl-2-thioxo-2,3-dihydro-4,7(1H,8H)-pteridinedione has 2 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 3-methyl-2-thioxo-2,3-dihydro-4,7(1H,8H)-pteridinedione?
The CAS number of 3-methyl-2-thioxo-2,3-dihydro-4,7(1H,8H)-pteridinedione is 70673-78-8.
What is the molecular formula of 3-methyl-2-thioxo-2,3-dihydro-4,7(1H,8H)-pteridinedione?
The molecular formula of 3-methyl-2-thioxo-2,3-dihydro-4,7(1H,8H)-pteridinedione is C7H6N4O2S.
What is the molecular weight of 3-methyl-2-thioxo-2,3-dihydro-4,7(1H,8H)-pteridinedione?
The molecular weight of 3-methyl-2-thioxo-2,3-dihydro-4,7(1H,8H)-pteridinedione is 210.02 g/mol.
Where can I buy 3-methyl-2-thioxo-2,3-dihydro-4,7(1H,8H)-pteridinedione?
You can request a quote for 3-methyl-2-thioxo-2,3-dihydro-4,7(1H,8H)-pteridinedione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-methyl-2-thioxo-2,3-dihydro-4,7(1H,8H)-pteridinedione?
Yes, KEHONG BIO provides custom synthesis services for 3-methyl-2-thioxo-2,3-dihydro-4,7(1H,8H)-pteridinedione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.