4-Chloro-5,6-dimethylthieno(2,3-d)pyrimidine
TL;DR: 4-Chloro-5,6-dimethylthieno(2,3-d)pyrimidine (CAS 109123-65-1) is a chemical compound with molecular formula C8H7ClN2S and molecular weight 198.00185 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-chloro-5,6-dimethylthieno[2,3-d]pyrimidine
Also Known As: 4-chloro-5,6-dimethylthieno[2,3-d]pyrimidine, Ethyl-2,2,2-d3 alcohol, 4-Chloro-5,6-dimethyl-thieno[2,3-d]pyrimidine, ETHYL-222-D3 ALCOHOL, Thieno[2,3-d]pyrimidine, 4-chloro-5,6-dimethyl-
Application Areas
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C8H7ClN2S |
| Molecular Weight | 198.00185 g/mol |
| XLogP | 3.3 |
| Topological Polar Surface Area (TPSA) | 54.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 198.00185 Da |
| Heavy Atoms | 12 |
| Complexity | 178.0 |
| SMILES | CC1=C(SC2=C1C(=NC=N2)Cl)C |
| InChIKey | HYOBKTVPACQCBR-UHFFFAOYSA-N |
Chemical Property Profile of 4-Chloro-5,6-dimethylthieno(2,3-d)pyrimidine
Property Insights of 4-Chloro-5,6-dimethylthieno(2,3-d)pyrimidine
The XLogP value of 3.3 indicates that 4-Chloro-5,6-dimethylthieno(2,3-d)pyrimidine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.0 Ų, 4-Chloro-5,6-dimethylthieno(2,3-d)pyrimidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Chloro-5,6-dimethylthieno(2,3-d)pyrimidine has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 4-Chloro-5,6-dimethylthieno(2,3-d)pyrimidine?
The CAS number of 4-Chloro-5,6-dimethylthieno(2,3-d)pyrimidine is 109123-65-1.
What is the molecular formula of 4-Chloro-5,6-dimethylthieno(2,3-d)pyrimidine?
The molecular formula of 4-Chloro-5,6-dimethylthieno(2,3-d)pyrimidine is C8H7ClN2S.
What is the molecular weight of 4-Chloro-5,6-dimethylthieno(2,3-d)pyrimidine?
The molecular weight of 4-Chloro-5,6-dimethylthieno(2,3-d)pyrimidine is 198.00185 g/mol.
Where can I buy 4-Chloro-5,6-dimethylthieno(2,3-d)pyrimidine?
You can request a quote for 4-Chloro-5,6-dimethylthieno(2,3-d)pyrimidine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-Chloro-5,6-dimethylthieno(2,3-d)pyrimidine?
Yes, CoreyChem provides custom synthesis services for 4-Chloro-5,6-dimethylthieno(2,3-d)pyrimidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.