![4-(4,5,6,7-Tetrahydro-benzo[b]thiophen-7-yl)-1H-imidazole structure](/static/products/245/245744-22-3.png)
4-(4,5,6,7-Tetrahydro-benzo[b]thiophen-7-yl)-1H-imidazole
TL;DR: 4-(4,5,6,7-Tetrahydro-benzo[b]thiophen-7-yl)-1H-imidazole (CAS 245744-22-3) is a chemical compound with molecular formula C11H12N2S and molecular weight 204.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(4,5,6,7-tetrahydro-1-benzothiophen-7-yl)-1H-imidazole
Also Known As: 1H-Imidazole, 5-(4,5,6,7-tetrahydrobenzo[b]thien-7-yl)-, 4-(4,5,6,7-tetrahydrobenzothiophen-7-yl)-3H-imidazole, 4-(4,5,6,7-Tetrahydro-benzo[b]thiophen-7-yl)-1H-imidazole
| Molecular Formula | C11H12N2S |
|---|---|
| Molecular Weight | 204.07 g/mol |
| LogP | 2.9394 |
| Topological Polar Surface Area | 28.68 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 204.07211 |
| Heavy Atoms | 14 |
| Complexity | 416.1892 |
Chemical Identifiers
| CAS Number | 245744-22-3 |
|---|---|
| SMILES | C1CC(C2=C(C1)C=CS2)C3=CN=CN3 |
Product Overview
4-(4,5,6,7-Tetrahydro-benzo[b]thiophen-7-yl)-1H-imidazole (CAS 245744-22-3), with molecular formula C11H12N2S and molecular weight 204.07 g/mol. IUPAC: 5-(4,5,6,7-tetrahydro-1-benzothiophen-7-yl)-1H-imidazole.
Chemical Property Profile of 4-(4,5,6,7-Tetrahydro-benzo[b]thiophen-7-yl)-1H-imidazole
Property Insights of 4-(4,5,6,7-Tetrahydro-benzo[b]thiophen-7-yl)-1H-imidazole
The XLogP value of 2.9394 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(4,5,6,7-Tetrahydro-benzo[b]thiophen-7-yl)-1H-imidazole. With a topological polar surface area (TPSA) of 28.68 Ų, 4-(4,5,6,7-Tetrahydro-benzo[b]thiophen-7-yl)-1H-imidazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(4,5,6,7-Tetrahydro-benzo[b]thiophen-7-yl)-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 4-(4,5,6,7-Tetrahydro-benzo[b]thiophen-7-yl)-1H-imidazole?
The CAS number of 4-(4,5,6,7-Tetrahydro-benzo[b]thiophen-7-yl)-1H-imidazole is 245744-22-3.
What is the molecular formula of 4-(4,5,6,7-Tetrahydro-benzo[b]thiophen-7-yl)-1H-imidazole?
The molecular formula of 4-(4,5,6,7-Tetrahydro-benzo[b]thiophen-7-yl)-1H-imidazole is C11H12N2S.
What is the molecular weight of 4-(4,5,6,7-Tetrahydro-benzo[b]thiophen-7-yl)-1H-imidazole?
The molecular weight of 4-(4,5,6,7-Tetrahydro-benzo[b]thiophen-7-yl)-1H-imidazole is 204.07 g/mol.
Where can I buy 4-(4,5,6,7-Tetrahydro-benzo[b]thiophen-7-yl)-1H-imidazole?
You can request a quote for 4-(4,5,6,7-Tetrahydro-benzo[b]thiophen-7-yl)-1H-imidazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(4,5,6,7-Tetrahydro-benzo[b]thiophen-7-yl)-1H-imidazole?
Yes, KEHONG BIO provides custom synthesis services for 4-(4,5,6,7-Tetrahydro-benzo[b]thiophen-7-yl)-1H-imidazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.