2-Imidazoline, 2-((m-chlorobenzyl)thio)-, monohydrobromide
TL;DR: 2-Imidazoline, 2-((m-chlorobenzyl)thio)-, monohydrobromide (CAS 7251-54-9) is a chemical compound with molecular formula C10H12BrClN2S and molecular weight 305.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(3-chlorophenyl)methylsulfanyl]-4,5-dihydro-1H-imidazol-1-ium bromide
Also Known As: 2-((m-Chlorobenzyl)thio)-2-imidazoline monohydrobromide, 2-IMIDAZOLINE, 2-((m-CHLOROBENZYL)THIO)-, MONOHYDROBROMIDE, 2-Imidazoline, 2-[(m-chlorobenzyl)thio]-, monohydrobromide, 2-[(3-chlorophenyl)methylsulfanyl]-4,5-dihydro-1H-imidazol-1-ium bromide, RefChem:1063491
| Molecular Formula | C10H12BrClN2S |
|---|---|
| Molecular Weight | 305.96 g/mol |
| LogP | -1.49 |
| Topological Polar Surface Area | 54.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 305.95932 |
| Heavy Atoms | 15 |
| Complexity | 220.0 |
Chemical Identifiers
| CAS Number | 7251-54-9 |
|---|---|
| SMILES | C1CN=C([NH2+]1)SCC2=CC(=CC=C2)Cl.[Br-] |
| InChIKey | RPNXOZVDYCBJRU-UHFFFAOYSA-N |
Product Overview
2-Imidazoline, 2-((m-chlorobenzyl)thio)-, monohydrobromide (CAS 7251-54-9), with molecular formula C10H12BrClN2S and molecular weight 305.96 g/mol. IUPAC: 2-[(3-chlorophenyl)methylsulfanyl]-4,5-dihydro-1H-imidazol-1-ium bromide.
Chemical Property Profile of 2-Imidazoline, 2-((m-chlorobenzyl)thio)-, monohydrobromide
Property Insights of 2-Imidazoline, 2-((m-chlorobenzyl)thio)-, monohydrobromide
The XLogP value of -1.49 indicates that 2-Imidazoline, 2-((m-chlorobenzyl)thio)-, monohydrobromide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 54.3 Ų, 2-Imidazoline, 2-((m-chlorobenzyl)thio)-, monohydrobromide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Imidazoline, 2-((m-chlorobenzyl)thio)-, monohydrobromide 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-Imidazoline, 2-((m-chlorobenzyl)thio)-, monohydrobromide?
The CAS number of 2-Imidazoline, 2-((m-chlorobenzyl)thio)-, monohydrobromide is 7251-54-9.
What is the molecular formula of 2-Imidazoline, 2-((m-chlorobenzyl)thio)-, monohydrobromide?
The molecular formula of 2-Imidazoline, 2-((m-chlorobenzyl)thio)-, monohydrobromide is C10H12BrClN2S.
What is the molecular weight of 2-Imidazoline, 2-((m-chlorobenzyl)thio)-, monohydrobromide?
The molecular weight of 2-Imidazoline, 2-((m-chlorobenzyl)thio)-, monohydrobromide is 305.96 g/mol.
Where can I buy 2-Imidazoline, 2-((m-chlorobenzyl)thio)-, monohydrobromide?
You can request a quote for 2-Imidazoline, 2-((m-chlorobenzyl)thio)-, monohydrobromide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Imidazoline, 2-((m-chlorobenzyl)thio)-, monohydrobromide?
Yes, KEHONG BIO provides custom synthesis services for 2-Imidazoline, 2-((m-chlorobenzyl)thio)-, monohydrobromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.