1-(2-Ethylbenzimidazol-1-yl)-3-(4-nitrophenoxy)propan-2-ol
TL;DR: 1-(2-Ethylbenzimidazol-1-yl)-3-(4-nitrophenoxy)propan-2-ol (CAS 294861-67-9) is a chemical compound with molecular formula C18H19N3O4 and molecular weight 341.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-ethylbenzimidazol-1-yl)-3-(4-nitrophenoxy)propan-2-ol
Also Known As: 1-(2-ethylbenzimidazol-1-yl)-3-(4-nitrophenoxy)propan-2-ol, AE-848/36199005, 1-(2-ethyl-1H-benzimidazol-1-yl)-3-(4-nitrophenoxy)propan-2-ol, 1-(2-ethyl-1H-benzimidazol-1-yl)-3-{4-nitrophenoxy}-2-propanol
| Molecular Formula | C18H19N3O4 |
|---|---|
| Molecular Weight | 341.14 g/mol |
| LogP | 2.9468 |
| Topological Polar Surface Area | 90.42 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 341.13754 |
| Heavy Atoms | 25 |
| Complexity | 873.6635 |
Chemical Identifiers
| CAS Number | 294861-67-9 |
|---|---|
| SMILES | CCC1=NC2=CC=CC=C2N1CC(COC3=CC=C(C=C3)[N+](=O)[O-])O |
Product Overview
1-(2-Ethylbenzimidazol-1-yl)-3-(4-nitrophenoxy)propan-2-ol (CAS 294861-67-9), with molecular formula C18H19N3O4 and molecular weight 341.14 g/mol. IUPAC: 1-(2-ethylbenzimidazol-1-yl)-3-(4-nitrophenoxy)propan-2-ol.
Chemical Property Profile of 1-(2-Ethylbenzimidazol-1-yl)-3-(4-nitrophenoxy)propan-2-ol
Property Insights of 1-(2-Ethylbenzimidazol-1-yl)-3-(4-nitrophenoxy)propan-2-ol
The XLogP value of 2.9468 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2-Ethylbenzimidazol-1-yl)-3-(4-nitrophenoxy)propan-2-ol. The TPSA of 90.42 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(2-Ethylbenzimidazol-1-yl)-3-(4-nitrophenoxy)propan-2-ol. Following Lipinski's Rule of Five, 1-(2-Ethylbenzimidazol-1-yl)-3-(4-nitrophenoxy)propan-2-ol 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 1-(2-Ethylbenzimidazol-1-yl)-3-(4-nitrophenoxy)propan-2-ol?
The CAS number of 1-(2-Ethylbenzimidazol-1-yl)-3-(4-nitrophenoxy)propan-2-ol is 294861-67-9.
What is the molecular formula of 1-(2-Ethylbenzimidazol-1-yl)-3-(4-nitrophenoxy)propan-2-ol?
The molecular formula of 1-(2-Ethylbenzimidazol-1-yl)-3-(4-nitrophenoxy)propan-2-ol is C18H19N3O4.
What is the molecular weight of 1-(2-Ethylbenzimidazol-1-yl)-3-(4-nitrophenoxy)propan-2-ol?
The molecular weight of 1-(2-Ethylbenzimidazol-1-yl)-3-(4-nitrophenoxy)propan-2-ol is 341.14 g/mol.
Where can I buy 1-(2-Ethylbenzimidazol-1-yl)-3-(4-nitrophenoxy)propan-2-ol?
You can request a quote for 1-(2-Ethylbenzimidazol-1-yl)-3-(4-nitrophenoxy)propan-2-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2-Ethylbenzimidazol-1-yl)-3-(4-nitrophenoxy)propan-2-ol?
Yes, KEHONG BIO provides custom synthesis services for 1-(2-Ethylbenzimidazol-1-yl)-3-(4-nitrophenoxy)propan-2-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.