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2-[(4-tert-butylphenyl)methylsulfanyl]-1H-benzimidazole
TL;DR: 2-[(4-tert-butylphenyl)methylsulfanyl]-1H-benzimidazole (CAS 296273-22-8) is a chemical compound with molecular formula C18H20N2S and molecular weight 296.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-tert-butylphenyl)methylsulfanyl]-1H-benzimidazole
Also Known As: UPCMLD0ENAT0400-0754:001, 2-[(4-tert-butylphenyl)methylsulfanyl]-1H-benzimidazole, 2-{[4-(tert-butyl)phenyl]methylthio}benzimidazole, 2-[(4-tert-butylbenzyl)sulfanyl]-1H-benzimidazole
| Molecular Formula | C18H20N2S |
|---|---|
| Molecular Weight | 296.13 g/mol |
| LogP | 5.1527 |
| Topological Polar Surface Area | 28.68 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 296.1347 |
| Heavy Atoms | 21 |
| Complexity | 702.7493 |
Chemical Identifiers
| CAS Number | 296273-22-8 |
|---|---|
| SMILES | CC(C)(C)C1=CC=C(C=C1)CSC2=NC3=CC=CC=C3N2 |
Product Overview
2-[(4-tert-butylphenyl)methylsulfanyl]-1H-benzimidazole (CAS 296273-22-8), with molecular formula C18H20N2S and molecular weight 296.13 g/mol. IUPAC: 2-[(4-tert-butylphenyl)methylsulfanyl]-1H-benzimidazole.
Chemical Property Profile of 2-[(4-tert-butylphenyl)methylsulfanyl]-1H-benzimidazole
Property Insights of 2-[(4-tert-butylphenyl)methylsulfanyl]-1H-benzimidazole
The XLogP value of 5.1527 indicates that 2-[(4-tert-butylphenyl)methylsulfanyl]-1H-benzimidazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 28.68 Ų, 2-[(4-tert-butylphenyl)methylsulfanyl]-1H-benzimidazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[(4-tert-butylphenyl)methylsulfanyl]-1H-benzimidazole has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-[(4-tert-butylphenyl)methylsulfanyl]-1H-benzimidazole?
The CAS number of 2-[(4-tert-butylphenyl)methylsulfanyl]-1H-benzimidazole is 296273-22-8.
What is the molecular formula of 2-[(4-tert-butylphenyl)methylsulfanyl]-1H-benzimidazole?
The molecular formula of 2-[(4-tert-butylphenyl)methylsulfanyl]-1H-benzimidazole is C18H20N2S.
What is the molecular weight of 2-[(4-tert-butylphenyl)methylsulfanyl]-1H-benzimidazole?
The molecular weight of 2-[(4-tert-butylphenyl)methylsulfanyl]-1H-benzimidazole is 296.13 g/mol.
Where can I buy 2-[(4-tert-butylphenyl)methylsulfanyl]-1H-benzimidazole?
You can request a quote for 2-[(4-tert-butylphenyl)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 2-[(4-tert-butylphenyl)methylsulfanyl]-1H-benzimidazole?
Yes, KEHONG BIO provides custom synthesis services for 2-[(4-tert-butylphenyl)methylsulfanyl]-1H-benzimidazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.