![4-((2,2-diethoxyethyl)thio)-2-(methylthio)-6,7-dihydro-5H-cyclopenta[4,5]thieno[2,3-d]pyrimidine structure](/static/products/799/799818-01-2.png)
4-((2,2-diethoxyethyl)thio)-2-(methylthio)-6,7-dihydro-5H-cyclopenta[4,5]thieno[2,3-d]pyrimidine
TL;DR: 4-((2,2-diethoxyethyl)thio)-2-(methylthio)-6,7-dihydro-5H-cyclopenta[4,5]thieno[2,3-d]pyrimidine (CAS 799818-01-2) is a chemical compound with molecular formula C16H22N2O2S3 and molecular weight 370.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
12-(2,2-diethoxyethylsulfanyl)-10-methylsulfanyl-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9,11-tetraene
Also Known As: 4-((2,2-diethoxyethyl)thio)-2-(methylthio)-6,7-dihydro-5H-cyclopenta[4,5]thieno[2,3-d]pyrimidine, 4-[(2,2-diethoxyethyl)sulfanyl]-2-(methylsulfanyl)-6,7-dihydro-5H-cyclopenta[4,5]thieno[2,3-d]pyrimidine
| Molecular Formula | C16H22N2O2S3 |
|---|---|
| Molecular Weight | 370.08 g/mol |
| LogP | 4.3931 |
| Topological Polar Surface Area | 44.24 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 370.08435 |
| Heavy Atoms | 23 |
| Complexity | 668.8794 |
Chemical Identifiers
| CAS Number | 799818-01-2 |
|---|---|
| SMILES | CCOC(CSC1=NC(=NC2=C1C3=C(S2)CCC3)SC)OCC |
Product Overview
4-((2,2-diethoxyethyl)thio)-2-(methylthio)-6,7-dihydro-5H-cyclopenta[4,5]thieno[2,3-d]pyrimidine (CAS 799818-01-2), with molecular formula C16H22N2O2S3 and molecular weight 370.08 g/mol. IUPAC: 12-(2,2-diethoxyethylsulfanyl)-10-methylsulfanyl-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9,11-tetraene.
Chemical Property Profile of 4-((2,2-diethoxyethyl)thio)-2-(methylthio)-6,7-dihydro-5H-cyclopenta[4,5]thieno[2,3-d]pyrimidine
Property Insights of 4-((2,2-diethoxyethyl)thio)-2-(methylthio)-6,7-dihydro-5H-cyclopenta[4,5]thieno[2,3-d]pyrimidine
The XLogP value of 4.3931 indicates that 4-((2,2-diethoxyethyl)thio)-2-(methylthio)-6,7-dihydro-5H-cyclopenta[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 44.24 Ų, 4-((2,2-diethoxyethyl)thio)-2-(methylthio)-6,7-dihydro-5H-cyclopenta[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)-2-(methylthio)-6,7-dihydro-5H-cyclopenta[4,5]thieno[2,3-d]pyrimidine has 0 hydrogen bond donor(s) and 7 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)-2-(methylthio)-6,7-dihydro-5H-cyclopenta[4,5]thieno[2,3-d]pyrimidine?
The CAS number of 4-((2,2-diethoxyethyl)thio)-2-(methylthio)-6,7-dihydro-5H-cyclopenta[4,5]thieno[2,3-d]pyrimidine is 799818-01-2.
What is the molecular formula of 4-((2,2-diethoxyethyl)thio)-2-(methylthio)-6,7-dihydro-5H-cyclopenta[4,5]thieno[2,3-d]pyrimidine?
The molecular formula of 4-((2,2-diethoxyethyl)thio)-2-(methylthio)-6,7-dihydro-5H-cyclopenta[4,5]thieno[2,3-d]pyrimidine is C16H22N2O2S3.
What is the molecular weight of 4-((2,2-diethoxyethyl)thio)-2-(methylthio)-6,7-dihydro-5H-cyclopenta[4,5]thieno[2,3-d]pyrimidine?
The molecular weight of 4-((2,2-diethoxyethyl)thio)-2-(methylthio)-6,7-dihydro-5H-cyclopenta[4,5]thieno[2,3-d]pyrimidine is 370.08 g/mol.
Where can I buy 4-((2,2-diethoxyethyl)thio)-2-(methylthio)-6,7-dihydro-5H-cyclopenta[4,5]thieno[2,3-d]pyrimidine?
You can request a quote for 4-((2,2-diethoxyethyl)thio)-2-(methylthio)-6,7-dihydro-5H-cyclopenta[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)-2-(methylthio)-6,7-dihydro-5H-cyclopenta[4,5]thieno[2,3-d]pyrimidine?
Yes, KEHONG BIO provides custom synthesis services for 4-((2,2-diethoxyethyl)thio)-2-(methylthio)-6,7-dihydro-5H-cyclopenta[4,5]thieno[2,3-d]pyrimidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.