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Ethanone, 2-[(3-chlorophenyl)amino]-1-(4-nitrophenyl)-
TL;DR: Ethanone, 2-[(3-chlorophenyl)amino]-1-(4-nitrophenyl)- (CAS 54583-53-8) is a chemical compound with molecular formula C14H11ClN2O3 and molecular weight 290.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-chloroanilino)-1-(4-nitrophenyl)ethanone
Also Known As: 2-(3-chloroanilino)-1-(4-nitrophenyl)ethanone, BIM-0007788.P001, Ethanone, 2-[(3-chlorophenyl)amino]-1-(4-nitrophenyl)-, 2-(3-Chlor-anilino)-1-(4-nitro-phenyl)-aethanon, 2-(3-Chloroanilino)-1-(4-nitrophenyl)ethan-1-one
| Molecular Formula | C14H11ClN2O3 |
|---|---|
| Molecular Weight | 290.05 g/mol |
| LogP | 3.543 |
| Topological Polar Surface Area | 72.24 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 290.0458 |
| Heavy Atoms | 20 |
| Complexity | 641.1222 |
Chemical Identifiers
| CAS Number | 54583-53-8 |
|---|---|
| SMILES | C1=CC(=CC(=C1)Cl)NCC(=O)C2=CC=C(C=C2)[N+](=O)[O-] |
Product Overview
Ethanone, 2-[(3-chlorophenyl)amino]-1-(4-nitrophenyl)- (CAS 54583-53-8), with molecular formula C14H11ClN2O3 and molecular weight 290.05 g/mol. IUPAC: 2-(3-chloroanilino)-1-(4-nitrophenyl)ethanone.
Chemical Property Profile of Ethanone, 2-[(3-chlorophenyl)amino]-1-(4-nitrophenyl)-
Property Insights of Ethanone, 2-[(3-chlorophenyl)amino]-1-(4-nitrophenyl)-
The XLogP value of 3.543 indicates that Ethanone, 2-[(3-chlorophenyl)amino]-1-(4-nitrophenyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.24 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethanone, 2-[(3-chlorophenyl)amino]-1-(4-nitrophenyl)-. Following Lipinski's Rule of Five, Ethanone, 2-[(3-chlorophenyl)amino]-1-(4-nitrophenyl)- 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 Ethanone, 2-[(3-chlorophenyl)amino]-1-(4-nitrophenyl)-?
The CAS number of Ethanone, 2-[(3-chlorophenyl)amino]-1-(4-nitrophenyl)- is 54583-53-8.
What is the molecular formula of Ethanone, 2-[(3-chlorophenyl)amino]-1-(4-nitrophenyl)-?
The molecular formula of Ethanone, 2-[(3-chlorophenyl)amino]-1-(4-nitrophenyl)- is C14H11ClN2O3.
What is the molecular weight of Ethanone, 2-[(3-chlorophenyl)amino]-1-(4-nitrophenyl)-?
The molecular weight of Ethanone, 2-[(3-chlorophenyl)amino]-1-(4-nitrophenyl)- is 290.05 g/mol.
Where can I buy Ethanone, 2-[(3-chlorophenyl)amino]-1-(4-nitrophenyl)-?
You can request a quote for Ethanone, 2-[(3-chlorophenyl)amino]-1-(4-nitrophenyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethanone, 2-[(3-chlorophenyl)amino]-1-(4-nitrophenyl)-?
Yes, KEHONG BIO provides custom synthesis services for Ethanone, 2-[(3-chlorophenyl)amino]-1-(4-nitrophenyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.