ethyl 2-[(6-nitro-2-phenyl-1H-1,3-benzimidazol-1-yl)oxy]propanoate
TL;DR: ethyl 2-[(6-nitro-2-phenyl-1H-1,3-benzimidazol-1-yl)oxy]propanoate (CAS 303148-99-4) is a chemical compound with molecular formula C18H17N3O5 and molecular weight 355.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-(6-nitro-2-phenylbenzimidazol-1-yl)oxypropanoate
Also Known As: Bionet1_000466, 11F-348S, ethyl 2-[(6-nitro-2-phenyl-1H-1,3-benzimidazol-1-yl)oxy]propanoate, ethyl 2-(6-nitro-2-phenylbenzimidazol-1-yl)oxypropanoate, ethyl 2-[(6-nitro-2-phenyl-1H-1,3-benzodiazol-1-yl)oxy]propanoate
| Molecular Formula | C18H17N3O5 |
|---|---|
| Molecular Weight | 355.12 g/mol |
| LogP | 2.9917 |
| Topological Polar Surface Area | 96.49 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 355.11682 |
| Heavy Atoms | 26 |
| Complexity | 952.1199 |
Chemical Identifiers
| CAS Number | 303148-99-4 |
|---|---|
| SMILES | CCOC(=O)C(C)ON1C2=C(C=CC(=C2)[N+](=O)[O-])N=C1C3=CC=CC=C3 |
Product Overview
ethyl 2-[(6-nitro-2-phenyl-1H-1,3-benzimidazol-1-yl)oxy]propanoate (CAS 303148-99-4), with molecular formula C18H17N3O5 and molecular weight 355.12 g/mol. IUPAC: ethyl 2-(6-nitro-2-phenylbenzimidazol-1-yl)oxypropanoate.
Chemical Property Profile of ethyl 2-[(6-nitro-2-phenyl-1H-1,3-benzimidazol-1-yl)oxy]propanoate
Property Insights of ethyl 2-[(6-nitro-2-phenyl-1H-1,3-benzimidazol-1-yl)oxy]propanoate
The XLogP value of 2.9917 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl 2-[(6-nitro-2-phenyl-1H-1,3-benzimidazol-1-yl)oxy]propanoate. The TPSA of 96.49 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 2-[(6-nitro-2-phenyl-1H-1,3-benzimidazol-1-yl)oxy]propanoate. Following Lipinski's Rule of Five, ethyl 2-[(6-nitro-2-phenyl-1H-1,3-benzimidazol-1-yl)oxy]propanoate has 0 hydrogen bond donor(s) and 6 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 ethyl 2-[(6-nitro-2-phenyl-1H-1,3-benzimidazol-1-yl)oxy]propanoate?
The CAS number of ethyl 2-[(6-nitro-2-phenyl-1H-1,3-benzimidazol-1-yl)oxy]propanoate is 303148-99-4.
What is the molecular formula of ethyl 2-[(6-nitro-2-phenyl-1H-1,3-benzimidazol-1-yl)oxy]propanoate?
The molecular formula of ethyl 2-[(6-nitro-2-phenyl-1H-1,3-benzimidazol-1-yl)oxy]propanoate is C18H17N3O5.
What is the molecular weight of ethyl 2-[(6-nitro-2-phenyl-1H-1,3-benzimidazol-1-yl)oxy]propanoate?
The molecular weight of ethyl 2-[(6-nitro-2-phenyl-1H-1,3-benzimidazol-1-yl)oxy]propanoate is 355.12 g/mol.
Where can I buy ethyl 2-[(6-nitro-2-phenyl-1H-1,3-benzimidazol-1-yl)oxy]propanoate?
You can request a quote for ethyl 2-[(6-nitro-2-phenyl-1H-1,3-benzimidazol-1-yl)oxy]propanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl 2-[(6-nitro-2-phenyl-1H-1,3-benzimidazol-1-yl)oxy]propanoate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 2-[(6-nitro-2-phenyl-1H-1,3-benzimidazol-1-yl)oxy]propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.