5,6-dimethyl-1H,4H-thieno(2,3-d)pyrimidine-4-thione
TL;DR: 5,6-dimethyl-1H,4H-thieno(2,3-d)pyrimidine-4-thione (CAS 307512-33-0) is a chemical compound with molecular formula C8H8N2S2 and molecular weight 196.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,6-dimethyl-3H-thieno[2,3-d]pyrimidine-4-thione
Also Known As: 5,6-Dimethyl-thieno[2,3-d]pyrimidine-4-thiol, 5,6-dimethylthieno[2,3-d]pyrimidine-4-thiol, 5,6-dimethylthieno[2,3-d]pyrimidine-4(3H)-thione, 5,6-dimethyl-3H-thieno[2,3-d]pyrimidine-4-thione, SDCCGMLS-0065531.P001
| Molecular Formula | C8H8N2S2 |
|---|---|
| Molecular Weight | 196.01 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 84.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 196.0129 |
| Heavy Atoms | 12 |
| Complexity | 239.0 |
Chemical Identifiers
| CAS Number | 307512-33-0 |
|---|---|
| SMILES | CC1=C(SC2=C1C(=S)NC=N2)C |
| InChIKey | BPXRXYWYEMPYQU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5,6-dimethyl-1H,4H-thieno(2,3-d)pyrimidine-4-thione (CAS 307512-33-0), with molecular formula C8H8N2S2 and molecular weight 196.01 g/mol. IUPAC: 5,6-dimethyl-3H-thieno[2,3-d]pyrimidine-4-thione.
Chemical Property Profile of 5,6-dimethyl-1H,4H-thieno(2,3-d)pyrimidine-4-thione
Property Insights of 5,6-dimethyl-1H,4H-thieno(2,3-d)pyrimidine-4-thione
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5,6-dimethyl-1H,4H-thieno(2,3-d)pyrimidine-4-thione. The TPSA of 84.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 5,6-dimethyl-1H,4H-thieno(2,3-d)pyrimidine-4-thione. Following Lipinski's Rule of Five, 5,6-dimethyl-1H,4H-thieno(2,3-d)pyrimidine-4-thione has 1 hydrogen bond donor(s) and 3 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 5,6-dimethyl-1H,4H-thieno(2,3-d)pyrimidine-4-thione?
The CAS number of 5,6-dimethyl-1H,4H-thieno(2,3-d)pyrimidine-4-thione is 307512-33-0.
What is the molecular formula of 5,6-dimethyl-1H,4H-thieno(2,3-d)pyrimidine-4-thione?
The molecular formula of 5,6-dimethyl-1H,4H-thieno(2,3-d)pyrimidine-4-thione is C8H8N2S2.
What is the molecular weight of 5,6-dimethyl-1H,4H-thieno(2,3-d)pyrimidine-4-thione?
The molecular weight of 5,6-dimethyl-1H,4H-thieno(2,3-d)pyrimidine-4-thione is 196.01 g/mol.
Where can I buy 5,6-dimethyl-1H,4H-thieno(2,3-d)pyrimidine-4-thione?
You can request a quote for 5,6-dimethyl-1H,4H-thieno(2,3-d)pyrimidine-4-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5,6-dimethyl-1H,4H-thieno(2,3-d)pyrimidine-4-thione?
Yes, KEHONG BIO provides custom synthesis services for 5,6-dimethyl-1H,4H-thieno(2,3-d)pyrimidine-4-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.