3-((4,5-Dihydro-1H-imidazol-2-yl)thio)-1H-indole
TL;DR: 3-((4,5-Dihydro-1H-imidazol-2-yl)thio)-1H-indole (CAS 62882-99-9) is a chemical compound with molecular formula C11H11N3S and molecular weight 217.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4,5-dihydro-1H-imidazol-2-ylsulfanyl)-1H-indole
Also Known As: Tinazoline, Tinazolina, Tinazolinum, Varsyl, Tinazoline [INN]
| Molecular Formula | C11H11N3S |
|---|---|
| Molecular Weight | 217.07 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 65.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 217.06737 |
| Heavy Atoms | 15 |
| Complexity | 267.0 |
Chemical Identifiers
| CAS Number | 62882-99-9 |
|---|---|
| SMILES | C1CN=C(N1)SC2=CNC3=CC=CC=C32 |
| InChIKey | JENBDJGHNIOHAJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-((4,5-Dihydro-1H-imidazol-2-yl)thio)-1H-indole (CAS 62882-99-9), with molecular formula C11H11N3S and molecular weight 217.07 g/mol. IUPAC: 3-(4,5-dihydro-1H-imidazol-2-ylsulfanyl)-1H-indole.
Chemical Property Profile of 3-((4,5-Dihydro-1H-imidazol-2-yl)thio)-1H-indole
Property Insights of 3-((4,5-Dihydro-1H-imidazol-2-yl)thio)-1H-indole
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-((4,5-Dihydro-1H-imidazol-2-yl)thio)-1H-indole. The TPSA of 65.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-((4,5-Dihydro-1H-imidazol-2-yl)thio)-1H-indole. Following Lipinski's Rule of Five, 3-((4,5-Dihydro-1H-imidazol-2-yl)thio)-1H-indole has 2 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 3-((4,5-Dihydro-1H-imidazol-2-yl)thio)-1H-indole?
The CAS number of 3-((4,5-Dihydro-1H-imidazol-2-yl)thio)-1H-indole is 62882-99-9.
What is the molecular formula of 3-((4,5-Dihydro-1H-imidazol-2-yl)thio)-1H-indole?
The molecular formula of 3-((4,5-Dihydro-1H-imidazol-2-yl)thio)-1H-indole is C11H11N3S.
What is the molecular weight of 3-((4,5-Dihydro-1H-imidazol-2-yl)thio)-1H-indole?
The molecular weight of 3-((4,5-Dihydro-1H-imidazol-2-yl)thio)-1H-indole is 217.07 g/mol.
Where can I buy 3-((4,5-Dihydro-1H-imidazol-2-yl)thio)-1H-indole?
You can request a quote for 3-((4,5-Dihydro-1H-imidazol-2-yl)thio)-1H-indole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-((4,5-Dihydro-1H-imidazol-2-yl)thio)-1H-indole?
Yes, KEHONG BIO provides custom synthesis services for 3-((4,5-Dihydro-1H-imidazol-2-yl)thio)-1H-indole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.