![propyl 4-[3-(1H-benzimidazol-1-yl)-2-hydroxypropoxy]benzoate structure](/static/products/439/439141-15-8.png)
propyl 4-[3-(1H-benzimidazol-1-yl)-2-hydroxypropoxy]benzoate
TL;DR: propyl 4-[3-(1H-benzimidazol-1-yl)-2-hydroxypropoxy]benzoate (CAS 439141-15-8) is a chemical compound with molecular formula C20H22N2O4 and molecular weight 354.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propyl 4-[3-(benzimidazol-1-yl)-2-hydroxypropoxy]benzoate
Also Known As: BAS 04934829, AE-848/11105019, propyl 4-(3-benzimidazolyl-2-hydroxypropoxy)benzoate, propyl 4-[3-(1H-benzimidazol-1-yl)-2-hydroxypropoxy]benzoate, propyl 4-[3-(benzimidazol-1-yl)-2-hydroxypropoxy]benzoate
| Molecular Formula | C20H22N2O4 |
|---|---|
| Molecular Weight | 354.16 g/mol |
| LogP | 3.043 |
| Topological Polar Surface Area | 73.58 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 354.15796 |
| Heavy Atoms | 26 |
| Complexity | 857.6335 |
Chemical Identifiers
| CAS Number | 439141-15-8 |
|---|---|
| SMILES | CCCOC(=O)C1=CC=C(C=C1)OCC(CN2C=NC3=CC=CC=C32)O |
Product Overview
propyl 4-[3-(1H-benzimidazol-1-yl)-2-hydroxypropoxy]benzoate (CAS 439141-15-8), with molecular formula C20H22N2O4 and molecular weight 354.16 g/mol. IUPAC: propyl 4-[3-(benzimidazol-1-yl)-2-hydroxypropoxy]benzoate.
Chemical Property Profile of propyl 4-[3-(1H-benzimidazol-1-yl)-2-hydroxypropoxy]benzoate
Property Insights of propyl 4-[3-(1H-benzimidazol-1-yl)-2-hydroxypropoxy]benzoate
The XLogP value of 3.043 indicates that propyl 4-[3-(1H-benzimidazol-1-yl)-2-hydroxypropoxy]benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.58 Ų falls within the moderate polarity range, balancing permeability and solubility for propyl 4-[3-(1H-benzimidazol-1-yl)-2-hydroxypropoxy]benzoate. Following Lipinski's Rule of Five, propyl 4-[3-(1H-benzimidazol-1-yl)-2-hydroxypropoxy]benzoate has 1 hydrogen bond donor(s) and 5 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 propyl 4-[3-(1H-benzimidazol-1-yl)-2-hydroxypropoxy]benzoate?
The CAS number of propyl 4-[3-(1H-benzimidazol-1-yl)-2-hydroxypropoxy]benzoate is 439141-15-8.
What is the molecular formula of propyl 4-[3-(1H-benzimidazol-1-yl)-2-hydroxypropoxy]benzoate?
The molecular formula of propyl 4-[3-(1H-benzimidazol-1-yl)-2-hydroxypropoxy]benzoate is C20H22N2O4.
What is the molecular weight of propyl 4-[3-(1H-benzimidazol-1-yl)-2-hydroxypropoxy]benzoate?
The molecular weight of propyl 4-[3-(1H-benzimidazol-1-yl)-2-hydroxypropoxy]benzoate is 354.16 g/mol.
Where can I buy propyl 4-[3-(1H-benzimidazol-1-yl)-2-hydroxypropoxy]benzoate?
You can request a quote for propyl 4-[3-(1H-benzimidazol-1-yl)-2-hydroxypropoxy]benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for propyl 4-[3-(1H-benzimidazol-1-yl)-2-hydroxypropoxy]benzoate?
Yes, KEHONG BIO provides custom synthesis services for propyl 4-[3-(1H-benzimidazol-1-yl)-2-hydroxypropoxy]benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.