![4-((2,2-diethoxyethyl)thio)-7-methyl-2-(methylthio)-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidine structure](/static/products/845/845985-06-0.png)
4-((2,2-diethoxyethyl)thio)-7-methyl-2-(methylthio)-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidine
TL;DR: 4-((2,2-diethoxyethyl)thio)-7-methyl-2-(methylthio)-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidine (CAS 845985-06-0) is a chemical compound with molecular formula C17H25N3O2S3 and molecular weight 399.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2,2-diethoxyethylsulfanyl)-11-methyl-5-methylsulfanyl-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5-tetraene
Also Known As: 4-((2,2-diethoxyethyl)thio)-7-methyl-2-(methylthio)-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidine, 4-[(2,2-diethoxyethyl)sulfanyl]-7-methyl-2-(methylsulfanyl)-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidine
| Molecular Formula | C17H25N3O2S3 |
|---|---|
| Molecular Weight | 399.11 g/mol |
| LogP | 3.8923 |
| Topological Polar Surface Area | 47.48 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 399.1109 |
| Heavy Atoms | 25 |
| Complexity | 716.71625 |
Chemical Identifiers
| CAS Number | 845985-06-0 |
|---|---|
| SMILES | CCOC(CSC1=NC(=NC2=C1C3=C(S2)CN(CC3)C)SC)OCC |
Product Overview
4-((2,2-diethoxyethyl)thio)-7-methyl-2-(methylthio)-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidine (CAS 845985-06-0), with molecular formula C17H25N3O2S3 and molecular weight 399.11 g/mol. IUPAC: 3-(2,2-diethoxyethylsulfanyl)-11-methyl-5-methylsulfanyl-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5-tetraene.
Chemical Property Profile of 4-((2,2-diethoxyethyl)thio)-7-methyl-2-(methylthio)-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidine
Property Insights of 4-((2,2-diethoxyethyl)thio)-7-methyl-2-(methylthio)-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidine
The XLogP value of 3.8923 indicates that 4-((2,2-diethoxyethyl)thio)-7-methyl-2-(methylthio)-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[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 47.48 Ų, 4-((2,2-diethoxyethyl)thio)-7-methyl-2-(methylthio)-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-((2,2-diethoxyethyl)thio)-7-methyl-2-(methylthio)-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidine has 0 hydrogen bond donor(s) and 8 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 4-((2,2-diethoxyethyl)thio)-7-methyl-2-(methylthio)-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidine?
The CAS number of 4-((2,2-diethoxyethyl)thio)-7-methyl-2-(methylthio)-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidine is 845985-06-0.
What is the molecular formula of 4-((2,2-diethoxyethyl)thio)-7-methyl-2-(methylthio)-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidine?
The molecular formula of 4-((2,2-diethoxyethyl)thio)-7-methyl-2-(methylthio)-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidine is C17H25N3O2S3.
What is the molecular weight of 4-((2,2-diethoxyethyl)thio)-7-methyl-2-(methylthio)-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidine?
The molecular weight of 4-((2,2-diethoxyethyl)thio)-7-methyl-2-(methylthio)-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidine is 399.11 g/mol.
Where can I buy 4-((2,2-diethoxyethyl)thio)-7-methyl-2-(methylthio)-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidine?
You can request a quote for 4-((2,2-diethoxyethyl)thio)-7-methyl-2-(methylthio)-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-((2,2-diethoxyethyl)thio)-7-methyl-2-(methylthio)-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidine?
Yes, KEHONG BIO provides custom synthesis services for 4-((2,2-diethoxyethyl)thio)-7-methyl-2-(methylthio)-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.