![5,6,7,8-Tetrahydro-4-(3-methylphenylamino)[1]benzothieno[2,3-d]pyrimidine-2-carboxylic acid ethyl ester structure](/static/products/1067/106778-64-7.webp)
5,6,7,8-Tetrahydro-4-(3-methylphenylamino)[1]benzothieno[2,3-d]pyrimidine-2-carboxylic acid ethyl ester
TL;DR: 5,6,7,8-Tetrahydro-4-(3-methylphenylamino)[1]benzothieno[2,3-d]pyrimidine-2-carboxylic acid ethyl ester (CAS 106778-64-7) is a chemical compound with molecular formula C20H21N3O2S and molecular weight 367.13544 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl 4-(3-methylanilino)-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidine-2-carboxylate
Also Known As: 5,6,7,8-Tetrahydro-4-(3-methylphenylamino)[1]benzothieno[2,3-d]pyrimidine-2-carboxylic acid ethyl ester, Ethyl 4-(3-methylanilino)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine-2-carboxylate, ethyl 3-[(3-methylphenyl)amino]-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6-tetraene-5-carboxylate, ethyl 4-(3-methylanilino)-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidine-2-carboxylate, ethyl 4-[(3-methylphenyl)amino]-5,6,7,8-tetrahydrobenzo[b]thiopheno[2,3-d]pyri midine-2-carboxylate
Technical Specifications
| Molecular Formula | C20H21N3O2S |
| Molecular Weight | 367.13544 g/mol |
| XLogP | 5.6 |
| Topological Polar Surface Area (TPSA) | 92.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 367.13544 Da |
| Heavy Atoms | 26 |
| Complexity | 505.0 |
| SMILES | CCOC(=O)C1=NC(=C2C3=C(CCCC3)SC2=N1)NC4=CC=CC(=C4)C |
| InChIKey | MSSBXYIQSZPIBD-UHFFFAOYSA-N |
Product Description
Applications: AC1MTT91 is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies AC1MTT91 (CAS 106778-64-7) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
A fine chemical supplied by CoreyChem, AC1MTT91 (CAS 106778-64-7) has the molecular formula C20H21N3O2S and a molecular weight of 367.14 g/mol. It is also known as 5,6,7,8-Tetrahydro-4-(3-methylphenylamino)[1]benzothieno[2,3-d]pyrimidine-2-carboxylic acid ethyl ester and Ethyl 4-(3-methylanilino)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine-2-carboxylate.
CoreyChem provides it with COA documentation, and custom synthesis from milligram to multi-kilogram scales is available on request. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of 5,6,7,8-Tetrahydro-4-(3-methylphenylamino)[1]benzothieno[2,3-d]pyrimidine-2-carboxylic acid ethyl ester
Property Insights of 5,6,7,8-Tetrahydro-4-(3-methylphenylamino)[1]benzothieno[2,3-d]pyrimidine-2-carboxylic acid ethyl ester
The XLogP value of 5.6 indicates that 5,6,7,8-Tetrahydro-4-(3-methylphenylamino)[1]benzothieno[2,3-d]pyrimidine-2-carboxylic acid ethyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 92.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 5,6,7,8-Tetrahydro-4-(3-methylphenylamino)[1]benzothieno[2,3-d]pyrimidine-2-carboxylic acid ethyl ester. Following Lipinski's Rule of Five, 5,6,7,8-Tetrahydro-4-(3-methylphenylamino)[1]benzothieno[2,3-d]pyrimidine-2-carboxylic acid ethyl ester has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 5,6,7,8-Tetrahydro-4-(3-methylphenylamino)[1]benzothieno[2,3-d]pyrimidine-2-carboxylic acid ethyl ester?
The CAS number of 5,6,7,8-Tetrahydro-4-(3-methylphenylamino)[1]benzothieno[2,3-d]pyrimidine-2-carboxylic acid ethyl ester is 106778-64-7.
What is the molecular formula of 5,6,7,8-Tetrahydro-4-(3-methylphenylamino)[1]benzothieno[2,3-d]pyrimidine-2-carboxylic acid ethyl ester?
The molecular formula of 5,6,7,8-Tetrahydro-4-(3-methylphenylamino)[1]benzothieno[2,3-d]pyrimidine-2-carboxylic acid ethyl ester is C20H21N3O2S.
What is the molecular weight of 5,6,7,8-Tetrahydro-4-(3-methylphenylamino)[1]benzothieno[2,3-d]pyrimidine-2-carboxylic acid ethyl ester?
The molecular weight of 5,6,7,8-Tetrahydro-4-(3-methylphenylamino)[1]benzothieno[2,3-d]pyrimidine-2-carboxylic acid ethyl ester is 367.13544 g/mol.
What are the applications of 5,6,7,8-Tetrahydro-4-(3-methylphenylamino)[1]benzothieno[2,3-d]pyrimidine-2-carboxylic acid ethyl ester?
AC1MTT91 is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies AC1MTT91 (CAS 106778-64-7) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
Where can I buy 5,6,7,8-Tetrahydro-4-(3-methylphenylamino)[1]benzothieno[2,3-d]pyrimidine-2-carboxylic acid ethyl ester?
You can request a quote for 5,6,7,8-Tetrahydro-4-(3-methylphenylamino)[1]benzothieno[2,3-d]pyrimidine-2-carboxylic acid ethyl ester directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 5,6,7,8-Tetrahydro-4-(3-methylphenylamino)[1]benzothieno[2,3-d]pyrimidine-2-carboxylic acid ethyl ester?
Yes, CoreyChem provides custom synthesis services for 5,6,7,8-Tetrahydro-4-(3-methylphenylamino)[1]benzothieno[2,3-d]pyrimidine-2-carboxylic acid ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.