![2-[(4-tert-butylbenzyl)sulfanyl]-5-methoxy-1H-benzimidazole structure](/static/products/3258/325823-05-0.webp)
2-[(4-tert-butylbenzyl)sulfanyl]-5-methoxy-1H-benzimidazole
TL;DR: 2-[(4-tert-butylbenzyl)sulfanyl]-5-methoxy-1H-benzimidazole (CAS 325823-05-0) is a chemical compound with molecular formula C19H22N2OS and molecular weight 326.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-tert-butylphenyl)methylsulfanyl]-6-methoxy-1H-benzimidazole
Also Known As: BAS 01044472, UPCMLD0ENAT0502-4466:001, AE-848/36959530, 2-[(4-tert-butylbenzyl)sulfanyl]-5-methoxy-1H-benzimidazole, 2-{[(4-TERT-BUTYLPHENYL)METHYL]SULFANYL}-5-METHOXY-1H-1,3-BENZODIAZOLE
| Molecular Formula | C19H22N2OS |
|---|---|
| Molecular Weight | 326.15 g/mol |
| LogP | 4.9 |
| Topological Polar Surface Area | 63.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 326.1453 |
| Heavy Atoms | 23 |
| Complexity | 376.0 |
Chemical Identifiers
| CAS Number | 325823-05-0 |
|---|---|
| SMILES | CC(C)(C)C1=CC=C(C=C1)CSC2=NC3=C(N2)C=C(C=C3)OC |
| InChIKey | OUXJOASRGMYGSX-UHFFFAOYSA-N |
Product Overview
2-[(4-tert-butylbenzyl)sulfanyl]-5-methoxy-1H-benzimidazole (CAS 325823-05-0), with molecular formula C19H22N2OS and molecular weight 326.15 g/mol. IUPAC: 2-[(4-tert-butylphenyl)methylsulfanyl]-6-methoxy-1H-benzimidazole.
Chemical Property Profile of 2-[(4-tert-butylbenzyl)sulfanyl]-5-methoxy-1H-benzimidazole
Property Insights of 2-[(4-tert-butylbenzyl)sulfanyl]-5-methoxy-1H-benzimidazole
The XLogP value of 4.9 indicates that 2-[(4-tert-butylbenzyl)sulfanyl]-5-methoxy-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 2-[(4-tert-butylbenzyl)sulfanyl]-5-methoxy-1H-benzimidazole. Following Lipinski's Rule of Five, 2-[(4-tert-butylbenzyl)sulfanyl]-5-methoxy-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 2-[(4-tert-butylbenzyl)sulfanyl]-5-methoxy-1H-benzimidazole?
The CAS number of 2-[(4-tert-butylbenzyl)sulfanyl]-5-methoxy-1H-benzimidazole is 325823-05-0.
What is the molecular formula of 2-[(4-tert-butylbenzyl)sulfanyl]-5-methoxy-1H-benzimidazole?
The molecular formula of 2-[(4-tert-butylbenzyl)sulfanyl]-5-methoxy-1H-benzimidazole is C19H22N2OS.
What is the molecular weight of 2-[(4-tert-butylbenzyl)sulfanyl]-5-methoxy-1H-benzimidazole?
The molecular weight of 2-[(4-tert-butylbenzyl)sulfanyl]-5-methoxy-1H-benzimidazole is 326.15 g/mol.
Where can I buy 2-[(4-tert-butylbenzyl)sulfanyl]-5-methoxy-1H-benzimidazole?
You can request a quote for 2-[(4-tert-butylbenzyl)sulfanyl]-5-methoxy-1H-benzimidazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(4-tert-butylbenzyl)sulfanyl]-5-methoxy-1H-benzimidazole?
Yes, KEHONG BIO provides custom synthesis services for 2-[(4-tert-butylbenzyl)sulfanyl]-5-methoxy-1H-benzimidazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.