1-Acetyl-4-(3-benzimidazolyl-2-hydroxypropoxy)benzene
TL;DR: 1-Acetyl-4-(3-benzimidazolyl-2-hydroxypropoxy)benzene (CAS 439141-11-4) is a chemical compound with molecular formula C18H18N2O3 and molecular weight 310.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[4-[3-(benzimidazol-1-yl)-2-hydroxypropoxy]phenyl]ethanone
Also Known As: BAS 04934828, 1-acetyl-4-(3-benzimidazolyl-2-hydroxypropoxy)benzene, BRD-A00876196-001-01-2, 1-[4-[3-(benzimidazol-1-yl)-2-hydroxypropoxy]phenyl]ethanone, 1-[4-(3-Benzoimidazol-1-yl-2-hydroxy-propoxy)-phenyl]-ethanone
| Molecular Formula | C18H18N2O3 |
|---|---|
| Molecular Weight | 310.13 g/mol |
| LogP | 2.6788 |
| Topological Polar Surface Area | 64.35 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 310.13174 |
| Heavy Atoms | 23 |
| Complexity | 808.5046 |
Chemical Identifiers
| CAS Number | 439141-11-4 |
|---|---|
| SMILES | CC(=O)C1=CC=C(C=C1)OCC(CN2C=NC3=CC=CC=C32)O |
Product Overview
1-Acetyl-4-(3-benzimidazolyl-2-hydroxypropoxy)benzene (CAS 439141-11-4), with molecular formula C18H18N2O3 and molecular weight 310.13 g/mol. IUPAC: 1-[4-[3-(benzimidazol-1-yl)-2-hydroxypropoxy]phenyl]ethanone.
Chemical Property Profile of 1-Acetyl-4-(3-benzimidazolyl-2-hydroxypropoxy)benzene
Property Insights of 1-Acetyl-4-(3-benzimidazolyl-2-hydroxypropoxy)benzene
The XLogP value of 2.6788 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Acetyl-4-(3-benzimidazolyl-2-hydroxypropoxy)benzene. The TPSA of 64.35 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Acetyl-4-(3-benzimidazolyl-2-hydroxypropoxy)benzene. Following Lipinski's Rule of Five, 1-Acetyl-4-(3-benzimidazolyl-2-hydroxypropoxy)benzene has 1 hydrogen bond donor(s) and 4 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-Acetyl-4-(3-benzimidazolyl-2-hydroxypropoxy)benzene?
The CAS number of 1-Acetyl-4-(3-benzimidazolyl-2-hydroxypropoxy)benzene is 439141-11-4.
What is the molecular formula of 1-Acetyl-4-(3-benzimidazolyl-2-hydroxypropoxy)benzene?
The molecular formula of 1-Acetyl-4-(3-benzimidazolyl-2-hydroxypropoxy)benzene is C18H18N2O3.
What is the molecular weight of 1-Acetyl-4-(3-benzimidazolyl-2-hydroxypropoxy)benzene?
The molecular weight of 1-Acetyl-4-(3-benzimidazolyl-2-hydroxypropoxy)benzene is 310.13 g/mol.
Where can I buy 1-Acetyl-4-(3-benzimidazolyl-2-hydroxypropoxy)benzene?
You can request a quote for 1-Acetyl-4-(3-benzimidazolyl-2-hydroxypropoxy)benzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Acetyl-4-(3-benzimidazolyl-2-hydroxypropoxy)benzene?
Yes, KEHONG BIO provides custom synthesis services for 1-Acetyl-4-(3-benzimidazolyl-2-hydroxypropoxy)benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.