Ethanone, 1-(3-bromo-4-methoxyphenyl)-2-((4,5-dihydro-1H-imidazol-2-yl)thio)-, monohydrochloride
TL;DR: Ethanone, 1-(3-bromo-4-methoxyphenyl)-2-((4,5-dihydro-1H-imidazol-2-yl)thio)-, monohydrochloride (CAS 160518-35-4) is a chemical compound with molecular formula C12H14BrClN2O2S and molecular weight 363.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3-bromo-4-methoxyphenyl)-2-(4,5-dihydro-1H-imidazol-2-ylsulfanyl)ethanone;hydrochloride
Also Known As: Ethanone, 1-(3-bromo-4-methoxyphenyl)-2-((4,5-dihydro-1H-imidazol-2-yl)thio)-, monohydrochloride, Acetophenone, 3'-bromo-2-(2-imidazolin-2-ylthio)-4'-methoxy-, monohydrochloride, 1-(3-bromo-4-methoxyphenyl)-2-(4,5-dihydro-1H-imidazol-2-ylsulfanyl)ethanone hydrochloride, 1-(3-Bromo-4-methoxyphenyl)-2-[(4,5-dihydro-1H-imidazol-2-yl)sulfanyl]ethan-1-one--hydrogen chloride (1/1), RefChem:341131
| Molecular Formula | C12H14BrClN2O2S |
|---|---|
| Molecular Weight | 363.96 g/mol |
| LogP | 2.7546 |
| Topological Polar Surface Area | 50.69 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 363.96478 |
| Heavy Atoms | 19 |
| Complexity | 496.61777 |
Chemical Identifiers
| CAS Number | 160518-35-4 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C(=O)CSC2=NCCN2)Br.Cl |
Product Overview
Ethanone, 1-(3-bromo-4-methoxyphenyl)-2-((4,5-dihydro-1H-imidazol-2-yl)thio)-, monohydrochloride (CAS 160518-35-4), with molecular formula C12H14BrClN2O2S and molecular weight 363.96 g/mol. IUPAC: 1-(3-bromo-4-methoxyphenyl)-2-(4,5-dihydro-1H-imidazol-2-ylsulfanyl)ethanone;hydrochloride.
Chemical Property Profile of Ethanone, 1-(3-bromo-4-methoxyphenyl)-2-((4,5-dihydro-1H-imidazol-2-yl)thio)-, monohydrochloride
Property Insights of Ethanone, 1-(3-bromo-4-methoxyphenyl)-2-((4,5-dihydro-1H-imidazol-2-yl)thio)-, monohydrochloride
The XLogP value of 2.7546 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethanone, 1-(3-bromo-4-methoxyphenyl)-2-((4,5-dihydro-1H-imidazol-2-yl)thio)-, monohydrochloride. With a topological polar surface area (TPSA) of 50.69 Ų, Ethanone, 1-(3-bromo-4-methoxyphenyl)-2-((4,5-dihydro-1H-imidazol-2-yl)thio)-, monohydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethanone, 1-(3-bromo-4-methoxyphenyl)-2-((4,5-dihydro-1H-imidazol-2-yl)thio)-, monohydrochloride has 1 hydrogen bond donor(s) and 5 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 Ethanone, 1-(3-bromo-4-methoxyphenyl)-2-((4,5-dihydro-1H-imidazol-2-yl)thio)-, monohydrochloride?
The CAS number of Ethanone, 1-(3-bromo-4-methoxyphenyl)-2-((4,5-dihydro-1H-imidazol-2-yl)thio)-, monohydrochloride is 160518-35-4.
What is the molecular formula of Ethanone, 1-(3-bromo-4-methoxyphenyl)-2-((4,5-dihydro-1H-imidazol-2-yl)thio)-, monohydrochloride?
The molecular formula of Ethanone, 1-(3-bromo-4-methoxyphenyl)-2-((4,5-dihydro-1H-imidazol-2-yl)thio)-, monohydrochloride is C12H14BrClN2O2S.
What is the molecular weight of Ethanone, 1-(3-bromo-4-methoxyphenyl)-2-((4,5-dihydro-1H-imidazol-2-yl)thio)-, monohydrochloride?
The molecular weight of Ethanone, 1-(3-bromo-4-methoxyphenyl)-2-((4,5-dihydro-1H-imidazol-2-yl)thio)-, monohydrochloride is 363.96 g/mol.
Where can I buy Ethanone, 1-(3-bromo-4-methoxyphenyl)-2-((4,5-dihydro-1H-imidazol-2-yl)thio)-, monohydrochloride?
You can request a quote for Ethanone, 1-(3-bromo-4-methoxyphenyl)-2-((4,5-dihydro-1H-imidazol-2-yl)thio)-, monohydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethanone, 1-(3-bromo-4-methoxyphenyl)-2-((4,5-dihydro-1H-imidazol-2-yl)thio)-, monohydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Ethanone, 1-(3-bromo-4-methoxyphenyl)-2-((4,5-dihydro-1H-imidazol-2-yl)thio)-, monohydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.