5-phenylsulfanyl-1H-imidazole
TL;DR: 5-phenylsulfanyl-1H-imidazole (CAS 123914-23-8) is a chemical compound with molecular formula C9H8N2S and molecular weight 176.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-phenylsulfanyl-1H-imidazole
Also Known As: 4-phenylsulfanyl-1h-imidazole, 5-phenylsulfanyl-1H-imidazole, 1H-Imidazole, 5-(phenylthio)-, 4-phenylsulfanyl-3H-imidazole
| Molecular Formula | C9H8N2S |
|---|---|
| Molecular Weight | 176.04 g/mol |
| LogP | 2.5609 |
| Topological Polar Surface Area | 28.68 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 176.04082 |
| Heavy Atoms | 12 |
| Complexity | 328.6939 |
Chemical Identifiers
| CAS Number | 123914-23-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)SC2=CN=CN2 |
Product Overview
5-phenylsulfanyl-1H-imidazole (CAS 123914-23-8), with molecular formula C9H8N2S and molecular weight 176.04 g/mol. IUPAC: 5-phenylsulfanyl-1H-imidazole.
Chemical Property Profile of 5-phenylsulfanyl-1H-imidazole
Property Insights of 5-phenylsulfanyl-1H-imidazole
The XLogP value of 2.5609 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-phenylsulfanyl-1H-imidazole. With a topological polar surface area (TPSA) of 28.68 Ų, 5-phenylsulfanyl-1H-imidazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-phenylsulfanyl-1H-imidazole has 1 hydrogen bond donor(s) and 2 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-phenylsulfanyl-1H-imidazole?
The CAS number of 5-phenylsulfanyl-1H-imidazole is 123914-23-8.
What is the molecular formula of 5-phenylsulfanyl-1H-imidazole?
The molecular formula of 5-phenylsulfanyl-1H-imidazole is C9H8N2S.
What is the molecular weight of 5-phenylsulfanyl-1H-imidazole?
The molecular weight of 5-phenylsulfanyl-1H-imidazole is 176.04 g/mol.
Where can I buy 5-phenylsulfanyl-1H-imidazole?
You can request a quote for 5-phenylsulfanyl-1H-imidazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-phenylsulfanyl-1H-imidazole?
Yes, KEHONG BIO provides custom synthesis services for 5-phenylsulfanyl-1H-imidazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.