4,7-bis(methylsulfanyl)-1H-imidazo[4,5-d]pyridazine
TL;DR: 4,7-bis(methylsulfanyl)-1H-imidazo[4,5-d]pyridazine (CAS 98277-49-7) is a chemical compound with molecular formula C7H8N4S2 and molecular weight 212.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,7-bis(methylsulfanyl)-1H-imidazo[4,5-d]pyridazine
Also Known As: 4,7-bis(methylsulfanyl)-1H-imidazo[4,5-d]pyridazine, 1h-imidazo[4,5-d]pyridazine, 4,7-bis(methylthio)-, AM-944/40947760, 4,7-Bis(methylthio)-1H-imidazo[4,5-d]pyridazine
| Molecular Formula | C7H8N4S2 |
|---|---|
| Molecular Weight | 212.02 g/mol |
| LogP | 1.7967 |
| Topological Polar Surface Area | 54.46 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 212.01904 |
| Heavy Atoms | 13 |
| Complexity | 387.3498 |
Chemical Identifiers
| CAS Number | 98277-49-7 |
|---|---|
| SMILES | CSC1=NN=C(C2=C1NC=N2)SC |
Product Overview
4,7-bis(methylsulfanyl)-1H-imidazo[4,5-d]pyridazine (CAS 98277-49-7), with molecular formula C7H8N4S2 and molecular weight 212.02 g/mol. IUPAC: 4,7-bis(methylsulfanyl)-1H-imidazo[4,5-d]pyridazine.
Chemical Property Profile of 4,7-bis(methylsulfanyl)-1H-imidazo[4,5-d]pyridazine
Property Insights of 4,7-bis(methylsulfanyl)-1H-imidazo[4,5-d]pyridazine
The XLogP value of 1.7967 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4,7-bis(methylsulfanyl)-1H-imidazo[4,5-d]pyridazine. With a topological polar surface area (TPSA) of 54.46 Ų, 4,7-bis(methylsulfanyl)-1H-imidazo[4,5-d]pyridazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,7-bis(methylsulfanyl)-1H-imidazo[4,5-d]pyridazine has 1 hydrogen bond donor(s) and 5 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 4,7-bis(methylsulfanyl)-1H-imidazo[4,5-d]pyridazine?
The CAS number of 4,7-bis(methylsulfanyl)-1H-imidazo[4,5-d]pyridazine is 98277-49-7.
What is the molecular formula of 4,7-bis(methylsulfanyl)-1H-imidazo[4,5-d]pyridazine?
The molecular formula of 4,7-bis(methylsulfanyl)-1H-imidazo[4,5-d]pyridazine is C7H8N4S2.
What is the molecular weight of 4,7-bis(methylsulfanyl)-1H-imidazo[4,5-d]pyridazine?
The molecular weight of 4,7-bis(methylsulfanyl)-1H-imidazo[4,5-d]pyridazine is 212.02 g/mol.
Where can I buy 4,7-bis(methylsulfanyl)-1H-imidazo[4,5-d]pyridazine?
You can request a quote for 4,7-bis(methylsulfanyl)-1H-imidazo[4,5-d]pyridazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,7-bis(methylsulfanyl)-1H-imidazo[4,5-d]pyridazine?
Yes, KEHONG BIO provides custom synthesis services for 4,7-bis(methylsulfanyl)-1H-imidazo[4,5-d]pyridazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.