1-(2-Bromoprop-2-enyl)-2-prop-2-enylsulfanylbenzimidazole
TL;DR: 1-(2-Bromoprop-2-enyl)-2-prop-2-enylsulfanylbenzimidazole (CAS 314769-75-0) is a chemical compound with molecular formula C13H13BrN2S and molecular weight 308.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-bromoprop-2-enyl)-2-prop-2-enylsulfanylbenzimidazole
Also Known As: BIM-0049650.P001, 1-(2-bromoprop-2-enyl)-2-prop-2-enylsulfanylbenzimidazole, 2-(allylthio)-1-(2-bromoallyl)-1H-benzo[d]imidazole, 1-(2-bromoprop-2-enyl)-2-prop-2-enylthiobenzimidazole, 1-(2-bromoprop-2-en-1-yl)-2-(prop-2-en-1-ylsulfanyl)-1H-benzimidazole
| Molecular Formula | C13H13BrN2S |
|---|---|
| Molecular Weight | 308.00 g/mol |
| LogP | 4.223 |
| Topological Polar Surface Area | 17.82 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 307.9983 |
| Heavy Atoms | 17 |
| Complexity | 559.54486 |
Chemical Identifiers
| CAS Number | 314769-75-0 |
|---|---|
| SMILES | C=CCSC1=NC2=CC=CC=C2N1CC(=C)Br |
Product Overview
1-(2-Bromoprop-2-enyl)-2-prop-2-enylsulfanylbenzimidazole (CAS 314769-75-0), with molecular formula C13H13BrN2S and molecular weight 308.00 g/mol. IUPAC: 1-(2-bromoprop-2-enyl)-2-prop-2-enylsulfanylbenzimidazole.
Chemical Property Profile of 1-(2-Bromoprop-2-enyl)-2-prop-2-enylsulfanylbenzimidazole
Property Insights of 1-(2-Bromoprop-2-enyl)-2-prop-2-enylsulfanylbenzimidazole
The XLogP value of 4.223 indicates that 1-(2-Bromoprop-2-enyl)-2-prop-2-enylsulfanylbenzimidazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.82 Ų, 1-(2-Bromoprop-2-enyl)-2-prop-2-enylsulfanylbenzimidazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(2-Bromoprop-2-enyl)-2-prop-2-enylsulfanylbenzimidazole 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 1-(2-Bromoprop-2-enyl)-2-prop-2-enylsulfanylbenzimidazole?
The CAS number of 1-(2-Bromoprop-2-enyl)-2-prop-2-enylsulfanylbenzimidazole is 314769-75-0.
What is the molecular formula of 1-(2-Bromoprop-2-enyl)-2-prop-2-enylsulfanylbenzimidazole?
The molecular formula of 1-(2-Bromoprop-2-enyl)-2-prop-2-enylsulfanylbenzimidazole is C13H13BrN2S.
What is the molecular weight of 1-(2-Bromoprop-2-enyl)-2-prop-2-enylsulfanylbenzimidazole?
The molecular weight of 1-(2-Bromoprop-2-enyl)-2-prop-2-enylsulfanylbenzimidazole is 308.00 g/mol.
Where can I buy 1-(2-Bromoprop-2-enyl)-2-prop-2-enylsulfanylbenzimidazole?
You can request a quote for 1-(2-Bromoprop-2-enyl)-2-prop-2-enylsulfanylbenzimidazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2-Bromoprop-2-enyl)-2-prop-2-enylsulfanylbenzimidazole?
Yes, KEHONG BIO provides custom synthesis services for 1-(2-Bromoprop-2-enyl)-2-prop-2-enylsulfanylbenzimidazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.