![2-methylsulfanyl-4-piperazin-1-yl-6,7,8,9-tetrahydro-[1]benzothiolo[3,2-d]pyrimidine structure](/static/products/904/904501-12-8.png)
2-methylsulfanyl-4-piperazin-1-yl-6,7,8,9-tetrahydro-[1]benzothiolo[3,2-d]pyrimidine
TL;DR: 2-methylsulfanyl-4-piperazin-1-yl-6,7,8,9-tetrahydro-[1]benzothiolo[3,2-d]pyrimidine (CAS 904501-12-8) is a chemical compound with molecular formula C15H20N4S2 and molecular weight 320.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methylsulfanyl-4-piperazin-1-yl-6,7,8,9-tetrahydro-[1]benzothiolo[3,2-d]pyrimidine
Also Known As: 2-methylsulfanyl-4-piperazin-1-yl-6,7,8,9-tetrahydro-[1]benzothiolo[3,2-d]pyrimidine, 2-(methylsulfanyl)-4-(piperazin-1-yl)-6,7,8,9-tetrahydro[1]benzothieno[3,2-d]pyrimidine, 2-(methylthio)-4-(piperazin-1-yl)-6,7,8,9-tetrahydrobenzo[4,5]thieno[3,2-d]pyrimidine
| Molecular Formula | C15H20N4S2 |
|---|---|
| Molecular Weight | 320.11 g/mol |
| LogP | 2.7016 |
| Topological Polar Surface Area | 41.05 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 320.11295 |
| Heavy Atoms | 21 |
| Complexity | 661.22766 |
Chemical Identifiers
| CAS Number | 904501-12-8 |
|---|---|
| SMILES | CSC1=NC2=C(C(=N1)N3CCNCC3)SC4=C2CCCC4 |
Product Overview
2-methylsulfanyl-4-piperazin-1-yl-6,7,8,9-tetrahydro-[1]benzothiolo[3,2-d]pyrimidine (CAS 904501-12-8), with molecular formula C15H20N4S2 and molecular weight 320.11 g/mol. IUPAC: 2-methylsulfanyl-4-piperazin-1-yl-6,7,8,9-tetrahydro-[1]benzothiolo[3,2-d]pyrimidine.
Chemical Property Profile of 2-methylsulfanyl-4-piperazin-1-yl-6,7,8,9-tetrahydro-[1]benzothiolo[3,2-d]pyrimidine
Property Insights of 2-methylsulfanyl-4-piperazin-1-yl-6,7,8,9-tetrahydro-[1]benzothiolo[3,2-d]pyrimidine
The XLogP value of 2.7016 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-methylsulfanyl-4-piperazin-1-yl-6,7,8,9-tetrahydro-[1]benzothiolo[3,2-d]pyrimidine. With a topological polar surface area (TPSA) of 41.05 Ų, 2-methylsulfanyl-4-piperazin-1-yl-6,7,8,9-tetrahydro-[1]benzothiolo[3,2-d]pyrimidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-methylsulfanyl-4-piperazin-1-yl-6,7,8,9-tetrahydro-[1]benzothiolo[3,2-d]pyrimidine has 1 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 2-methylsulfanyl-4-piperazin-1-yl-6,7,8,9-tetrahydro-[1]benzothiolo[3,2-d]pyrimidine?
The CAS number of 2-methylsulfanyl-4-piperazin-1-yl-6,7,8,9-tetrahydro-[1]benzothiolo[3,2-d]pyrimidine is 904501-12-8.
What is the molecular formula of 2-methylsulfanyl-4-piperazin-1-yl-6,7,8,9-tetrahydro-[1]benzothiolo[3,2-d]pyrimidine?
The molecular formula of 2-methylsulfanyl-4-piperazin-1-yl-6,7,8,9-tetrahydro-[1]benzothiolo[3,2-d]pyrimidine is C15H20N4S2.
What is the molecular weight of 2-methylsulfanyl-4-piperazin-1-yl-6,7,8,9-tetrahydro-[1]benzothiolo[3,2-d]pyrimidine?
The molecular weight of 2-methylsulfanyl-4-piperazin-1-yl-6,7,8,9-tetrahydro-[1]benzothiolo[3,2-d]pyrimidine is 320.11 g/mol.
Where can I buy 2-methylsulfanyl-4-piperazin-1-yl-6,7,8,9-tetrahydro-[1]benzothiolo[3,2-d]pyrimidine?
You can request a quote for 2-methylsulfanyl-4-piperazin-1-yl-6,7,8,9-tetrahydro-[1]benzothiolo[3,2-d]pyrimidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-methylsulfanyl-4-piperazin-1-yl-6,7,8,9-tetrahydro-[1]benzothiolo[3,2-d]pyrimidine?
Yes, KEHONG BIO provides custom synthesis services for 2-methylsulfanyl-4-piperazin-1-yl-6,7,8,9-tetrahydro-[1]benzothiolo[3,2-d]pyrimidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.