2-(Allylthio)benzimidazole
TL;DR: 2-(Allylthio)benzimidazole (CAS 51389-04-9) is a chemical compound with molecular formula C10H10N2S and molecular weight 190.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-prop-2-enylsulfanyl-1H-benzimidazole
Also Known As: 2-(ALLYLTHIO)BENZIMIDAZOLE, 2-(allylthio)-1H-benzo[d]imidazole, 2-allylthiobenzimidazole, Maybridge1_006097, 2-(allylthio)-1H-benzimidazole
| Molecular Formula | C10H10N2S |
|---|---|
| Molecular Weight | 190.06 g/mol |
| LogP | 2.841 |
| Topological Polar Surface Area | 28.68 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 190.05647 |
| Heavy Atoms | 13 |
| Complexity | 386.5369 |
Chemical Identifiers
| CAS Number | 51389-04-9 |
|---|---|
| SMILES | C=CCSC1=NC2=CC=CC=C2N1 |
Product Overview
2-(Allylthio)benzimidazole (CAS 51389-04-9), with molecular formula C10H10N2S and molecular weight 190.06 g/mol. IUPAC: 2-prop-2-enylsulfanyl-1H-benzimidazole.
Chemical Property Profile of 2-(Allylthio)benzimidazole
Property Insights of 2-(Allylthio)benzimidazole
The XLogP value of 2.841 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(Allylthio)benzimidazole. With a topological polar surface area (TPSA) of 28.68 Ų, 2-(Allylthio)benzimidazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Allylthio)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-(Allylthio)benzimidazole?
The CAS number of 2-(Allylthio)benzimidazole is 51389-04-9.
What is the molecular formula of 2-(Allylthio)benzimidazole?
The molecular formula of 2-(Allylthio)benzimidazole is C10H10N2S.
What is the molecular weight of 2-(Allylthio)benzimidazole?
The molecular weight of 2-(Allylthio)benzimidazole is 190.06 g/mol.
Where can I buy 2-(Allylthio)benzimidazole?
You can request a quote for 2-(Allylthio)benzimidazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Allylthio)benzimidazole?
Yes, KEHONG BIO provides custom synthesis services for 2-(Allylthio)benzimidazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.