![2-[(4-chlorophenyl)methylsulfanylmethyl]-1H-benzimidazole structure](/static/products/5490/54906-45-5.webp)
2-[(4-chlorophenyl)methylsulfanylmethyl]-1H-benzimidazole
TL;DR: 2-[(4-chlorophenyl)methylsulfanylmethyl]-1H-benzimidazole (CAS 54906-45-5) is a chemical compound with molecular formula C15H13ClN2S and molecular weight 288.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-chlorophenyl)methylsulfanylmethyl]-1H-benzimidazole
Also Known As: ChemDiv3_011514, IDI1_029072, (benzimidazol-2-ylmethylthio)(4-chlorophenyl)methane, 2-[(4-chlorophenyl)methylsulfanylmethyl]-1H-benzimidazole, BRD-K06810062-001-01-4
| Molecular Formula | C15H13ClN2S |
|---|---|
| Molecular Weight | 288.05 g/mol |
| LogP | 4.6497 |
| Topological Polar Surface Area | 28.68 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 288.0488 |
| Heavy Atoms | 19 |
| Complexity | 642.9332 |
Chemical Identifiers
| CAS Number | 54906-45-5 |
|---|---|
| SMILES | C1=CC=C2C(=C1)NC(=N2)CSCC3=CC=C(C=C3)Cl |
Product Overview
2-[(4-chlorophenyl)methylsulfanylmethyl]-1H-benzimidazole (CAS 54906-45-5), with molecular formula C15H13ClN2S and molecular weight 288.05 g/mol. IUPAC: 2-[(4-chlorophenyl)methylsulfanylmethyl]-1H-benzimidazole.
Chemical Property Profile of 2-[(4-chlorophenyl)methylsulfanylmethyl]-1H-benzimidazole
Property Insights of 2-[(4-chlorophenyl)methylsulfanylmethyl]-1H-benzimidazole
The XLogP value of 4.6497 indicates that 2-[(4-chlorophenyl)methylsulfanylmethyl]-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-chlorophenyl)methylsulfanylmethyl]-1H-benzimidazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[(4-chlorophenyl)methylsulfanylmethyl]-1H-benzimidazole 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 2-[(4-chlorophenyl)methylsulfanylmethyl]-1H-benzimidazole?
The CAS number of 2-[(4-chlorophenyl)methylsulfanylmethyl]-1H-benzimidazole is 54906-45-5.
What is the molecular formula of 2-[(4-chlorophenyl)methylsulfanylmethyl]-1H-benzimidazole?
The molecular formula of 2-[(4-chlorophenyl)methylsulfanylmethyl]-1H-benzimidazole is C15H13ClN2S.
What is the molecular weight of 2-[(4-chlorophenyl)methylsulfanylmethyl]-1H-benzimidazole?
The molecular weight of 2-[(4-chlorophenyl)methylsulfanylmethyl]-1H-benzimidazole is 288.05 g/mol.
Where can I buy 2-[(4-chlorophenyl)methylsulfanylmethyl]-1H-benzimidazole?
You can request a quote for 2-[(4-chlorophenyl)methylsulfanylmethyl]-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-chlorophenyl)methylsulfanylmethyl]-1H-benzimidazole?
Yes, KEHONG BIO provides custom synthesis services for 2-[(4-chlorophenyl)methylsulfanylmethyl]-1H-benzimidazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.