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6-methoxy-2-[(4-methylphenyl)methylsulfanyl]-1H-benzimidazole
TL;DR: 6-methoxy-2-[(4-methylphenyl)methylsulfanyl]-1H-benzimidazole (CAS 309735-05-5) is a chemical compound with molecular formula C16H16N2OS and molecular weight 284.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-methoxy-2-[(4-methylphenyl)methylsulfanyl]-1H-benzimidazole
Also Known As: EX-A5366, 5-methoxy-2-[(4-methylbenzyl)sulfanyl]-1H-benzimidazole, 6-methoxy-2-[(4-methylphenyl)methylsulfanyl]-1H-benzimidazole, J3.513.617G, 6-methoxy-2-[(4-methylbenzyl)sulfanyl]-1H-benzimidazole
| Molecular Formula | C16H16N2OS |
|---|---|
| Molecular Weight | 284.10 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 63.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 284.09833 |
| Heavy Atoms | 20 |
| Complexity | 307.0 |
Chemical Identifiers
| CAS Number | 309735-05-5 |
|---|---|
| SMILES | CC1=CC=C(C=C1)CSC2=NC3=C(N2)C=C(C=C3)OC |
| InChIKey | HRUYBRGMRSNLNW-UHFFFAOYSA-N |
Product Overview
6-methoxy-2-[(4-methylphenyl)methylsulfanyl]-1H-benzimidazole (CAS 309735-05-5), with molecular formula C16H16N2OS and molecular weight 284.10 g/mol. IUPAC: 6-methoxy-2-[(4-methylphenyl)methylsulfanyl]-1H-benzimidazole.
Chemical Property Profile of 6-methoxy-2-[(4-methylphenyl)methylsulfanyl]-1H-benzimidazole
Property Insights of 6-methoxy-2-[(4-methylphenyl)methylsulfanyl]-1H-benzimidazole
The XLogP value of 3.6 indicates that 6-methoxy-2-[(4-methylphenyl)methylsulfanyl]-1H-benzimidazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-methoxy-2-[(4-methylphenyl)methylsulfanyl]-1H-benzimidazole. Following Lipinski's Rule of Five, 6-methoxy-2-[(4-methylphenyl)methylsulfanyl]-1H-benzimidazole 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 6-methoxy-2-[(4-methylphenyl)methylsulfanyl]-1H-benzimidazole?
The CAS number of 6-methoxy-2-[(4-methylphenyl)methylsulfanyl]-1H-benzimidazole is 309735-05-5.
What is the molecular formula of 6-methoxy-2-[(4-methylphenyl)methylsulfanyl]-1H-benzimidazole?
The molecular formula of 6-methoxy-2-[(4-methylphenyl)methylsulfanyl]-1H-benzimidazole is C16H16N2OS.
What is the molecular weight of 6-methoxy-2-[(4-methylphenyl)methylsulfanyl]-1H-benzimidazole?
The molecular weight of 6-methoxy-2-[(4-methylphenyl)methylsulfanyl]-1H-benzimidazole is 284.10 g/mol.
Where can I buy 6-methoxy-2-[(4-methylphenyl)methylsulfanyl]-1H-benzimidazole?
You can request a quote for 6-methoxy-2-[(4-methylphenyl)methylsulfanyl]-1H-benzimidazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-methoxy-2-[(4-methylphenyl)methylsulfanyl]-1H-benzimidazole?
Yes, KEHONG BIO provides custom synthesis services for 6-methoxy-2-[(4-methylphenyl)methylsulfanyl]-1H-benzimidazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.