3-(4-{3,5-bisnitrophenoxy}phenyl)-N-(3-chlorophenyl)propanamide
TL;DR: 3-(4-{3,5-bisnitrophenoxy}phenyl)-N-(3-chlorophenyl)propanamide (CAS 312943-66-1) is a chemical compound with molecular formula C21H16ClN3O6 and molecular weight 441.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-chlorophenyl)-3-[4-(3,5-dinitrophenoxy)phenyl]propanamide
Also Known As: BAS 00448942, 3-(4-{3,5-bisnitrophenoxy}phenyl)-N-(3-chlorophenyl)propanamide, N-(3-Chloro-phenyl)-3-[4-(3,5-dinitro-phenoxy)-phenyl]-propionamide, N-(3-chlorophenyl)-3-[4-(3,5-dinitrophenoxy)phenyl]propanamide
| Molecular Formula | C21H16ClN3O6 |
|---|---|
| Molecular Weight | 441.07 g/mol |
| LogP | 5.52 |
| Topological Polar Surface Area | 124.61 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 441.07275 |
| Heavy Atoms | 31 |
| Complexity | 1101.9639 |
Chemical Identifiers
| CAS Number | 312943-66-1 |
|---|---|
| SMILES | C1=CC(=CC(=C1)Cl)NC(=O)CCC2=CC=C(C=C2)OC3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-] |
Product Overview
3-(4-{3,5-bisnitrophenoxy}phenyl)-N-(3-chlorophenyl)propanamide (CAS 312943-66-1), with molecular formula C21H16ClN3O6 and molecular weight 441.07 g/mol. IUPAC: N-(3-chlorophenyl)-3-[4-(3,5-dinitrophenoxy)phenyl]propanamide.
Chemical Property Profile of 3-(4-{3,5-bisnitrophenoxy}phenyl)-N-(3-chlorophenyl)propanamide
Property Insights of 3-(4-{3,5-bisnitrophenoxy}phenyl)-N-(3-chlorophenyl)propanamide
The XLogP value of 5.52 indicates that 3-(4-{3,5-bisnitrophenoxy}phenyl)-N-(3-chlorophenyl)propanamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 124.61 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(4-{3,5-bisnitrophenoxy}phenyl)-N-(3-chlorophenyl)propanamide. Following Lipinski's Rule of Five, 3-(4-{3,5-bisnitrophenoxy}phenyl)-N-(3-chlorophenyl)propanamide has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-(4-{3,5-bisnitrophenoxy}phenyl)-N-(3-chlorophenyl)propanamide?
The CAS number of 3-(4-{3,5-bisnitrophenoxy}phenyl)-N-(3-chlorophenyl)propanamide is 312943-66-1.
What is the molecular formula of 3-(4-{3,5-bisnitrophenoxy}phenyl)-N-(3-chlorophenyl)propanamide?
The molecular formula of 3-(4-{3,5-bisnitrophenoxy}phenyl)-N-(3-chlorophenyl)propanamide is C21H16ClN3O6.
What is the molecular weight of 3-(4-{3,5-bisnitrophenoxy}phenyl)-N-(3-chlorophenyl)propanamide?
The molecular weight of 3-(4-{3,5-bisnitrophenoxy}phenyl)-N-(3-chlorophenyl)propanamide is 441.07 g/mol.
Where can I buy 3-(4-{3,5-bisnitrophenoxy}phenyl)-N-(3-chlorophenyl)propanamide?
You can request a quote for 3-(4-{3,5-bisnitrophenoxy}phenyl)-N-(3-chlorophenyl)propanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(4-{3,5-bisnitrophenoxy}phenyl)-N-(3-chlorophenyl)propanamide?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-{3,5-bisnitrophenoxy}phenyl)-N-(3-chlorophenyl)propanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.