4-bromobenzyl 1-phenyl-1H-imidazol-2-yl sulfide
TL;DR: 4-bromobenzyl 1-phenyl-1H-imidazol-2-yl sulfide (CAS 478046-27-4) is a chemical compound with molecular formula C16H13BrN2S and molecular weight 344.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-bromophenyl)methylsulfanyl]-1-phenylimidazole
Also Known As: 4-bromobenzyl 1-phenyl-1H-imidazol-2-yl sulfide, 2-[(4-bromophenyl)methylsulfanyl]-1-phenylimidazole, 2-{[(4-bromophenyl)methyl]sulfanyl}-1-phenyl-1H-imidazole
| Molecular Formula | C16H13BrN2S |
|---|---|
| Molecular Weight | 344.00 g/mol |
| LogP | 4.9271 |
| Topological Polar Surface Area | 17.82 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 343.9983 |
| Heavy Atoms | 20 |
| Complexity | 677.2113 |
Chemical Identifiers
| CAS Number | 478046-27-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)N2C=CN=C2SCC3=CC=C(C=C3)Br |
Product Overview
4-bromobenzyl 1-phenyl-1H-imidazol-2-yl sulfide (CAS 478046-27-4), with molecular formula C16H13BrN2S and molecular weight 344.00 g/mol. IUPAC: 2-[(4-bromophenyl)methylsulfanyl]-1-phenylimidazole.
Chemical Property Profile of 4-bromobenzyl 1-phenyl-1H-imidazol-2-yl sulfide
Property Insights of 4-bromobenzyl 1-phenyl-1H-imidazol-2-yl sulfide
The XLogP value of 4.9271 indicates that 4-bromobenzyl 1-phenyl-1H-imidazol-2-yl sulfide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.82 Ų, 4-bromobenzyl 1-phenyl-1H-imidazol-2-yl sulfide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-bromobenzyl 1-phenyl-1H-imidazol-2-yl sulfide has 0 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-bromobenzyl 1-phenyl-1H-imidazol-2-yl sulfide?
The CAS number of 4-bromobenzyl 1-phenyl-1H-imidazol-2-yl sulfide is 478046-27-4.
What is the molecular formula of 4-bromobenzyl 1-phenyl-1H-imidazol-2-yl sulfide?
The molecular formula of 4-bromobenzyl 1-phenyl-1H-imidazol-2-yl sulfide is C16H13BrN2S.
What is the molecular weight of 4-bromobenzyl 1-phenyl-1H-imidazol-2-yl sulfide?
The molecular weight of 4-bromobenzyl 1-phenyl-1H-imidazol-2-yl sulfide is 344.00 g/mol.
Where can I buy 4-bromobenzyl 1-phenyl-1H-imidazol-2-yl sulfide?
You can request a quote for 4-bromobenzyl 1-phenyl-1H-imidazol-2-yl sulfide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-bromobenzyl 1-phenyl-1H-imidazol-2-yl sulfide?
Yes, KEHONG BIO provides custom synthesis services for 4-bromobenzyl 1-phenyl-1H-imidazol-2-yl sulfide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.