N-(3,4-dichlorophenyl)-2-(4-nitroimidazol-1-yl)acetamide
TL;DR: N-(3,4-dichlorophenyl)-2-(4-nitroimidazol-1-yl)acetamide (CAS 126401-80-7) is a chemical compound with molecular formula C11H8Cl2N4O3 and molecular weight 314.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3,4-dichlorophenyl)-2-(4-nitroimidazol-1-yl)acetamide
Also Known As: BAS 00384764, N-(3,4-dichlorophenyl)-2-(4-nitroimidazol-1-yl)acetamide, N-(3,4-dichlorophenyl)-2-{4-nitro-1H-imidazol-1-yl}acetamide, N-(3,4-dichlorophenyl)-2-(4-nitroimidazolyl)acetamide, N-(3,4-Dichloro-phenyl)-2-(4-nitro-imidazol-1-yl)-acetamide
| Molecular Formula | C11H8Cl2N4O3 |
|---|---|
| Molecular Weight | 314.00 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 92.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 313.99734 |
| Heavy Atoms | 20 |
| Complexity | 379.0 |
Chemical Identifiers
| CAS Number | 126401-80-7 |
|---|---|
| SMILES | C1=CC(=C(C=C1NC(=O)CN2C=C(N=C2)[N+](=O)[O-])Cl)Cl |
| InChIKey | OKSGQGJCRGDHNG-UHFFFAOYSA-N |
Product Overview
N-(3,4-dichlorophenyl)-2-(4-nitroimidazol-1-yl)acetamide (CAS 126401-80-7), with molecular formula C11H8Cl2N4O3 and molecular weight 314.00 g/mol. IUPAC: N-(3,4-dichlorophenyl)-2-(4-nitroimidazol-1-yl)acetamide.
Chemical Property Profile of N-(3,4-dichlorophenyl)-2-(4-nitroimidazol-1-yl)acetamide
Property Insights of N-(3,4-dichlorophenyl)-2-(4-nitroimidazol-1-yl)acetamide
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(3,4-dichlorophenyl)-2-(4-nitroimidazol-1-yl)acetamide. The TPSA of 92.7 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(3,4-dichlorophenyl)-2-(4-nitroimidazol-1-yl)acetamide. Following Lipinski's Rule of Five, N-(3,4-dichlorophenyl)-2-(4-nitroimidazol-1-yl)acetamide 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 N-(3,4-dichlorophenyl)-2-(4-nitroimidazol-1-yl)acetamide?
The CAS number of N-(3,4-dichlorophenyl)-2-(4-nitroimidazol-1-yl)acetamide is 126401-80-7.
What is the molecular formula of N-(3,4-dichlorophenyl)-2-(4-nitroimidazol-1-yl)acetamide?
The molecular formula of N-(3,4-dichlorophenyl)-2-(4-nitroimidazol-1-yl)acetamide is C11H8Cl2N4O3.
What is the molecular weight of N-(3,4-dichlorophenyl)-2-(4-nitroimidazol-1-yl)acetamide?
The molecular weight of N-(3,4-dichlorophenyl)-2-(4-nitroimidazol-1-yl)acetamide is 314.00 g/mol.
Where can I buy N-(3,4-dichlorophenyl)-2-(4-nitroimidazol-1-yl)acetamide?
You can request a quote for N-(3,4-dichlorophenyl)-2-(4-nitroimidazol-1-yl)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3,4-dichlorophenyl)-2-(4-nitroimidazol-1-yl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for N-(3,4-dichlorophenyl)-2-(4-nitroimidazol-1-yl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.