![Ethyl 4-chloro-5-methylthieno[2,3-d]pyrimidine-6-carboxylate structure](/static/products/1016/101667-98-5.webp)
Ethyl 4-chloro-5-methylthieno[2,3-d]pyrimidine-6-carboxylate
TL;DR: Ethyl 4-chloro-5-methylthieno[2,3-d]pyrimidine-6-carboxylate (CAS 101667-98-5) is a chemical compound with molecular formula C10H9ClN2O2S and molecular weight 256.00732 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl 4-chloro-5-methylthieno[2,3-d]pyrimidine-6-carboxylate
Also Known As: ethyl 4-chloro-5-methylthieno[2,3-d]pyrimidine-6-carboxylate, 0435AA, Thieno[2,3-d]pyrimidine-6-carboxylic acid, 4-chloro-5-methyl-, ethyl ester, 4CH-017197, F3284-7831
Technical Specifications
| Molecular Formula | C10H9ClN2O2S |
| Molecular Weight | 256.00732 g/mol |
| XLogP | 3.4 |
| Topological Polar Surface Area (TPSA) | 80.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 256.00732 Da |
| Heavy Atoms | 16 |
| Complexity | 280.0 |
| SMILES | CCOC(=O)C1=C(C2=C(S1)N=CN=C2Cl)C |
| InChIKey | FIIBPXMYXHXUPI-UHFFFAOYSA-N |
Chemical Property Profile of Ethyl 4-chloro-5-methylthieno[2,3-d]pyrimidine-6-carboxylate
Property Insights of Ethyl 4-chloro-5-methylthieno[2,3-d]pyrimidine-6-carboxylate
The XLogP value of 3.4 indicates that Ethyl 4-chloro-5-methylthieno[2,3-d]pyrimidine-6-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 4-chloro-5-methylthieno[2,3-d]pyrimidine-6-carboxylate. Following Lipinski's Rule of Five, Ethyl 4-chloro-5-methylthieno[2,3-d]pyrimidine-6-carboxylate has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Ethyl 4-chloro-5-methylthieno[2,3-d]pyrimidine-6-carboxylate?
The CAS number of Ethyl 4-chloro-5-methylthieno[2,3-d]pyrimidine-6-carboxylate is 101667-98-5.
What is the molecular formula of Ethyl 4-chloro-5-methylthieno[2,3-d]pyrimidine-6-carboxylate?
The molecular formula of Ethyl 4-chloro-5-methylthieno[2,3-d]pyrimidine-6-carboxylate is C10H9ClN2O2S.
What is the molecular weight of Ethyl 4-chloro-5-methylthieno[2,3-d]pyrimidine-6-carboxylate?
The molecular weight of Ethyl 4-chloro-5-methylthieno[2,3-d]pyrimidine-6-carboxylate is 256.00732 g/mol.
Where can I buy Ethyl 4-chloro-5-methylthieno[2,3-d]pyrimidine-6-carboxylate?
You can request a quote for Ethyl 4-chloro-5-methylthieno[2,3-d]pyrimidine-6-carboxylate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Ethyl 4-chloro-5-methylthieno[2,3-d]pyrimidine-6-carboxylate?
Yes, CoreyChem provides custom synthesis services for Ethyl 4-chloro-5-methylthieno[2,3-d]pyrimidine-6-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.