![5-(methylsulfanyl)-2,3,8,9,10,11-hexahydro[1]benzothieno[3,2-e]imidazo[1,2-c]pyrimidine structure](/static/products/370/370077-69-3.png)
5-(methylsulfanyl)-2,3,8,9,10,11-hexahydro[1]benzothieno[3,2-e]imidazo[1,2-c]pyrimidine
TL;DR: 5-(methylsulfanyl)-2,3,8,9,10,11-hexahydro[1]benzothieno[3,2-e]imidazo[1,2-c]pyrimidine (CAS 370077-69-3) is a chemical compound with molecular formula C13H15N3S2 and molecular weight 277.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-methylsulfanyl-10-thia-3,6,8-triazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,7,11(16)-tetraene
Also Known As: 5-(methylsulfanyl)-2,3,8,9,10,11-hexahydro[1]benzothieno[3,2-e]imidazo[1,2-c]pyrimidine, 5-(methylthio)-2,3,8,9,10,11-hexahydrobenzo[4,5]thieno[3,2-e]imidazo[1,2-c]pyrimidine
| Molecular Formula | C13H15N3S2 |
|---|---|
| Molecular Weight | 277.07 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 81.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 277.07074 |
| Heavy Atoms | 18 |
| Complexity | 420.0 |
Chemical Identifiers
| CAS Number | 370077-69-3 |
|---|---|
| SMILES | CSC1=NC2=C(C3=C(S2)CCCC3)C4=NCCN41 |
| InChIKey | LEIVYAXGUSIDBH-UHFFFAOYSA-N |
Product Overview
5-(methylsulfanyl)-2,3,8,9,10,11-hexahydro[1]benzothieno[3,2-e]imidazo[1,2-c]pyrimidine (CAS 370077-69-3), with molecular formula C13H15N3S2 and molecular weight 277.07 g/mol. IUPAC: 7-methylsulfanyl-10-thia-3,6,8-triazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,7,11(16)-tetraene.
Chemical Property Profile of 5-(methylsulfanyl)-2,3,8,9,10,11-hexahydro[1]benzothieno[3,2-e]imidazo[1,2-c]pyrimidine
Property Insights of 5-(methylsulfanyl)-2,3,8,9,10,11-hexahydro[1]benzothieno[3,2-e]imidazo[1,2-c]pyrimidine
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(methylsulfanyl)-2,3,8,9,10,11-hexahydro[1]benzothieno[3,2-e]imidazo[1,2-c]pyrimidine. The TPSA of 81.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(methylsulfanyl)-2,3,8,9,10,11-hexahydro[1]benzothieno[3,2-e]imidazo[1,2-c]pyrimidine. Following Lipinski's Rule of Five, 5-(methylsulfanyl)-2,3,8,9,10,11-hexahydro[1]benzothieno[3,2-e]imidazo[1,2-c]pyrimidine has 0 hydrogen bond donor(s) and 4 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)-2,3,8,9,10,11-hexahydro[1]benzothieno[3,2-e]imidazo[1,2-c]pyrimidine?
The CAS number of 5-(methylsulfanyl)-2,3,8,9,10,11-hexahydro[1]benzothieno[3,2-e]imidazo[1,2-c]pyrimidine is 370077-69-3.
What is the molecular formula of 5-(methylsulfanyl)-2,3,8,9,10,11-hexahydro[1]benzothieno[3,2-e]imidazo[1,2-c]pyrimidine?
The molecular formula of 5-(methylsulfanyl)-2,3,8,9,10,11-hexahydro[1]benzothieno[3,2-e]imidazo[1,2-c]pyrimidine is C13H15N3S2.
What is the molecular weight of 5-(methylsulfanyl)-2,3,8,9,10,11-hexahydro[1]benzothieno[3,2-e]imidazo[1,2-c]pyrimidine?
The molecular weight of 5-(methylsulfanyl)-2,3,8,9,10,11-hexahydro[1]benzothieno[3,2-e]imidazo[1,2-c]pyrimidine is 277.07 g/mol.
Where can I buy 5-(methylsulfanyl)-2,3,8,9,10,11-hexahydro[1]benzothieno[3,2-e]imidazo[1,2-c]pyrimidine?
You can request a quote for 5-(methylsulfanyl)-2,3,8,9,10,11-hexahydro[1]benzothieno[3,2-e]imidazo[1,2-c]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)-2,3,8,9,10,11-hexahydro[1]benzothieno[3,2-e]imidazo[1,2-c]pyrimidine?
Yes, KEHONG BIO provides custom synthesis services for 5-(methylsulfanyl)-2,3,8,9,10,11-hexahydro[1]benzothieno[3,2-e]imidazo[1,2-c]pyrimidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.