1-(3-Methylbut-3-en-2-yl)benzimidazole
TL;DR: 1-(3-Methylbut-3-en-2-yl)benzimidazole (CAS 186527-71-9) is a chemical compound with molecular formula C12H14N2 and molecular weight 186.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3-methylbut-3-en-2-yl)benzimidazole
Also Known As: 1-(3-methylbut-3-en-2-yl)benzimidazole, 1H-Benzimidazole,1-(1,2-dimethyl-2-propenyl)-(9CI), N-(3-Methylbut-4-en-2-yl)-1H-benzimidazole, 1-(1,2-Dimethyl-2-propenyl)-1H-benzimidazole, 1-(1,2-Dimethyl-2-propenyl)-1H-benzimidazole #
| Molecular Formula | C12H14N2 |
|---|---|
| Molecular Weight | 186.12 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 17.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 186.11569 |
| Heavy Atoms | 14 |
| Complexity | 224.0 |
Chemical Identifiers
| CAS Number | 186527-71-9 |
|---|---|
| SMILES | CC(C(=C)C)N1C=NC2=CC=CC=C21 |
| InChIKey | XDUDLMDQYVRKST-UHFFFAOYSA-N |
Product Overview
1-(3-Methylbut-3-en-2-yl)benzimidazole (CAS 186527-71-9), with molecular formula C12H14N2 and molecular weight 186.12 g/mol. IUPAC: 1-(3-methylbut-3-en-2-yl)benzimidazole.
Chemical Property Profile of 1-(3-Methylbut-3-en-2-yl)benzimidazole
Property Insights of 1-(3-Methylbut-3-en-2-yl)benzimidazole
The XLogP value of 3.2 indicates that 1-(3-Methylbut-3-en-2-yl)benzimidazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.8 Ų, 1-(3-Methylbut-3-en-2-yl)benzimidazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(3-Methylbut-3-en-2-yl)benzimidazole has 0 hydrogen bond donor(s) and 1 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-(3-Methylbut-3-en-2-yl)benzimidazole?
The CAS number of 1-(3-Methylbut-3-en-2-yl)benzimidazole is 186527-71-9.
What is the molecular formula of 1-(3-Methylbut-3-en-2-yl)benzimidazole?
The molecular formula of 1-(3-Methylbut-3-en-2-yl)benzimidazole is C12H14N2.
What is the molecular weight of 1-(3-Methylbut-3-en-2-yl)benzimidazole?
The molecular weight of 1-(3-Methylbut-3-en-2-yl)benzimidazole is 186.12 g/mol.
Where can I buy 1-(3-Methylbut-3-en-2-yl)benzimidazole?
You can request a quote for 1-(3-Methylbut-3-en-2-yl)benzimidazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(3-Methylbut-3-en-2-yl)benzimidazole?
Yes, KEHONG BIO provides custom synthesis services for 1-(3-Methylbut-3-en-2-yl)benzimidazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.