2-(4,5-dihydro-1H-imidazol-2-ylsulfanyl)-1-oxidopyridin-1-ium
TL;DR: 2-(4,5-dihydro-1H-imidazol-2-ylsulfanyl)-1-oxidopyridin-1-ium (CAS 90764-93-5) is a chemical compound with molecular formula C8H9N3OS and molecular weight 195.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4,5-dihydro-1H-imidazol-2-ylsulfanyl)-1-oxidopyridin-1-ium
Also Known As: 2-(4,5-Dihydro-1H-imidazol-2-ylsulfanyl)pyridine 1-oxide, 2-(4,5-dihydro-1H-imidazol-2-ylsulfanyl)-1-oxidopyridin-1-ium
| Molecular Formula | C8H9N3OS |
|---|---|
| Molecular Weight | 195.05 g/mol |
| LogP | 0.0 |
| Topological Polar Surface Area | 75.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 195.04663 |
| Heavy Atoms | 13 |
| Complexity | 210.0 |
Chemical Identifiers
| CAS Number | 90764-93-5 |
|---|---|
| SMILES | C1CN=C(N1)SC2=CC=CC=[N+]2[O-] |
| InChIKey | PGDHPDGMQKUZTP-UHFFFAOYSA-N |
Product Overview
2-(4,5-dihydro-1H-imidazol-2-ylsulfanyl)-1-oxidopyridin-1-ium (CAS 90764-93-5), with molecular formula C8H9N3OS and molecular weight 195.05 g/mol. IUPAC: 2-(4,5-dihydro-1H-imidazol-2-ylsulfanyl)-1-oxidopyridin-1-ium.
Chemical Property Profile of 2-(4,5-dihydro-1H-imidazol-2-ylsulfanyl)-1-oxidopyridin-1-ium
Property Insights of 2-(4,5-dihydro-1H-imidazol-2-ylsulfanyl)-1-oxidopyridin-1-ium
The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(4,5-dihydro-1H-imidazol-2-ylsulfanyl)-1-oxidopyridin-1-ium. The TPSA of 75.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(4,5-dihydro-1H-imidazol-2-ylsulfanyl)-1-oxidopyridin-1-ium. Following Lipinski's Rule of Five, 2-(4,5-dihydro-1H-imidazol-2-ylsulfanyl)-1-oxidopyridin-1-ium has 1 hydrogen bond donor(s) and 3 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-(4,5-dihydro-1H-imidazol-2-ylsulfanyl)-1-oxidopyridin-1-ium?
The CAS number of 2-(4,5-dihydro-1H-imidazol-2-ylsulfanyl)-1-oxidopyridin-1-ium is 90764-93-5.
What is the molecular formula of 2-(4,5-dihydro-1H-imidazol-2-ylsulfanyl)-1-oxidopyridin-1-ium?
The molecular formula of 2-(4,5-dihydro-1H-imidazol-2-ylsulfanyl)-1-oxidopyridin-1-ium is C8H9N3OS.
What is the molecular weight of 2-(4,5-dihydro-1H-imidazol-2-ylsulfanyl)-1-oxidopyridin-1-ium?
The molecular weight of 2-(4,5-dihydro-1H-imidazol-2-ylsulfanyl)-1-oxidopyridin-1-ium is 195.05 g/mol.
Where can I buy 2-(4,5-dihydro-1H-imidazol-2-ylsulfanyl)-1-oxidopyridin-1-ium?
You can request a quote for 2-(4,5-dihydro-1H-imidazol-2-ylsulfanyl)-1-oxidopyridin-1-ium directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4,5-dihydro-1H-imidazol-2-ylsulfanyl)-1-oxidopyridin-1-ium?
Yes, KEHONG BIO provides custom synthesis services for 2-(4,5-dihydro-1H-imidazol-2-ylsulfanyl)-1-oxidopyridin-1-ium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.