![5-(methylsulfanyl)-6,7,8,9-tetrahydro[1]benzothieno[3,2-e]tetrazolo[1,5-a]pyrimidine structure](/static/products/799/799778-34-0.png)
5-(methylsulfanyl)-6,7,8,9-tetrahydro[1]benzothieno[3,2-e]tetrazolo[1,5-a]pyrimidine
TL;DR: 5-(methylsulfanyl)-6,7,8,9-tetrahydro[1]benzothieno[3,2-e]tetrazolo[1,5-a]pyrimidine (CAS 799778-34-0) is a chemical compound with molecular formula C11H11N5S2 and molecular weight 277.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-methylsulfanyl-16-thia-2,3,4,5,7-pentazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(9),3,5,7,10(15)-pentaene
Also Known As: 5-(methylsulfanyl)-6,7,8,9-tetrahydro[1]benzothieno[3,2-e]tetrazolo[1,5-a]pyrimidine, 5-(methylthio)-6,7,8,9-tetrahydrobenzo[4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidine
| Molecular Formula | C11H11N5S2 |
|---|---|
| Molecular Weight | 277.05 g/mol |
| LogP | 2.3347 |
| Topological Polar Surface Area | 55.97 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 277.0456 |
| Heavy Atoms | 18 |
| Complexity | 744.6357 |
Chemical Identifiers
| CAS Number | 799778-34-0 |
|---|---|
| SMILES | CSC1=NC2=NN=NN2C3=C1C4=C(S3)CCCC4 |
Product Overview
5-(methylsulfanyl)-6,7,8,9-tetrahydro[1]benzothieno[3,2-e]tetrazolo[1,5-a]pyrimidine (CAS 799778-34-0), with molecular formula C11H11N5S2 and molecular weight 277.05 g/mol. IUPAC: 8-methylsulfanyl-16-thia-2,3,4,5,7-pentazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(9),3,5,7,10(15)-pentaene.
Chemical Property Profile of 5-(methylsulfanyl)-6,7,8,9-tetrahydro[1]benzothieno[3,2-e]tetrazolo[1,5-a]pyrimidine
Property Insights of 5-(methylsulfanyl)-6,7,8,9-tetrahydro[1]benzothieno[3,2-e]tetrazolo[1,5-a]pyrimidine
The XLogP value of 2.3347 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(methylsulfanyl)-6,7,8,9-tetrahydro[1]benzothieno[3,2-e]tetrazolo[1,5-a]pyrimidine. With a topological polar surface area (TPSA) of 55.97 Ų, 5-(methylsulfanyl)-6,7,8,9-tetrahydro[1]benzothieno[3,2-e]tetrazolo[1,5-a]pyrimidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-(methylsulfanyl)-6,7,8,9-tetrahydro[1]benzothieno[3,2-e]tetrazolo[1,5-a]pyrimidine has 0 hydrogen bond donor(s) and 6 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 5-(methylsulfanyl)-6,7,8,9-tetrahydro[1]benzothieno[3,2-e]tetrazolo[1,5-a]pyrimidine?
The CAS number of 5-(methylsulfanyl)-6,7,8,9-tetrahydro[1]benzothieno[3,2-e]tetrazolo[1,5-a]pyrimidine is 799778-34-0.
What is the molecular formula of 5-(methylsulfanyl)-6,7,8,9-tetrahydro[1]benzothieno[3,2-e]tetrazolo[1,5-a]pyrimidine?
The molecular formula of 5-(methylsulfanyl)-6,7,8,9-tetrahydro[1]benzothieno[3,2-e]tetrazolo[1,5-a]pyrimidine is C11H11N5S2.
What is the molecular weight of 5-(methylsulfanyl)-6,7,8,9-tetrahydro[1]benzothieno[3,2-e]tetrazolo[1,5-a]pyrimidine?
The molecular weight of 5-(methylsulfanyl)-6,7,8,9-tetrahydro[1]benzothieno[3,2-e]tetrazolo[1,5-a]pyrimidine is 277.05 g/mol.
Where can I buy 5-(methylsulfanyl)-6,7,8,9-tetrahydro[1]benzothieno[3,2-e]tetrazolo[1,5-a]pyrimidine?
You can request a quote for 5-(methylsulfanyl)-6,7,8,9-tetrahydro[1]benzothieno[3,2-e]tetrazolo[1,5-a]pyrimidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(methylsulfanyl)-6,7,8,9-tetrahydro[1]benzothieno[3,2-e]tetrazolo[1,5-a]pyrimidine?
Yes, KEHONG BIO provides custom synthesis services for 5-(methylsulfanyl)-6,7,8,9-tetrahydro[1]benzothieno[3,2-e]tetrazolo[1,5-a]pyrimidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.