1-(1-phenylethyl)-2-(propan-2-yl)-1H-1,3-benzodiazole
TL;DR: 1-(1-phenylethyl)-2-(propan-2-yl)-1H-1,3-benzodiazole (CAS 477502-58-2) is a chemical compound with molecular formula C18H20N2 and molecular weight 264.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(1-phenylethyl)-2-propan-2-ylbenzimidazole
Also Known As: 1-(1-phenylethyl)-2-(propan-2-yl)-1H-1,3-benzodiazole, 2-(methylethyl)-1-(phenylethyl)benzimidazole, 1-(1-phenylethyl)-2-propan-2-ylbenzimidazole, F0853-0047, 1-(1-phenylethyl)-2-(propan-2-yl)-1H-benzimidazole
| Molecular Formula | C18H20N2 |
|---|---|
| Molecular Weight | 264.16 g/mol |
| LogP | 4.769 |
| Topological Polar Surface Area | 17.82 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 264.16266 |
| Heavy Atoms | 20 |
| Complexity | 710.6212 |
Chemical Identifiers
| CAS Number | 477502-58-2 |
|---|---|
| SMILES | CC(C)C1=NC2=CC=CC=C2N1C(C)C3=CC=CC=C3 |
Product Overview
1-(1-phenylethyl)-2-(propan-2-yl)-1H-1,3-benzodiazole (CAS 477502-58-2), with molecular formula C18H20N2 and molecular weight 264.16 g/mol. IUPAC: 1-(1-phenylethyl)-2-propan-2-ylbenzimidazole.
Chemical Property Profile of 1-(1-phenylethyl)-2-(propan-2-yl)-1H-1,3-benzodiazole
Property Insights of 1-(1-phenylethyl)-2-(propan-2-yl)-1H-1,3-benzodiazole
The XLogP value of 4.769 indicates that 1-(1-phenylethyl)-2-(propan-2-yl)-1H-1,3-benzodiazole 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-(1-phenylethyl)-2-(propan-2-yl)-1H-1,3-benzodiazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(1-phenylethyl)-2-(propan-2-yl)-1H-1,3-benzodiazole 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-(1-phenylethyl)-2-(propan-2-yl)-1H-1,3-benzodiazole?
The CAS number of 1-(1-phenylethyl)-2-(propan-2-yl)-1H-1,3-benzodiazole is 477502-58-2.
What is the molecular formula of 1-(1-phenylethyl)-2-(propan-2-yl)-1H-1,3-benzodiazole?
The molecular formula of 1-(1-phenylethyl)-2-(propan-2-yl)-1H-1,3-benzodiazole is C18H20N2.
What is the molecular weight of 1-(1-phenylethyl)-2-(propan-2-yl)-1H-1,3-benzodiazole?
The molecular weight of 1-(1-phenylethyl)-2-(propan-2-yl)-1H-1,3-benzodiazole is 264.16 g/mol.
Where can I buy 1-(1-phenylethyl)-2-(propan-2-yl)-1H-1,3-benzodiazole?
You can request a quote for 1-(1-phenylethyl)-2-(propan-2-yl)-1H-1,3-benzodiazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(1-phenylethyl)-2-(propan-2-yl)-1H-1,3-benzodiazole?
Yes, KEHONG BIO provides custom synthesis services for 1-(1-phenylethyl)-2-(propan-2-yl)-1H-1,3-benzodiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.