N-(2-chloro-4-nitrophenyl)-3-(2-ethylbutanoylamino)benzamide
TL;DR: N-(2-chloro-4-nitrophenyl)-3-(2-ethylbutanoylamino)benzamide (CAS 825596-99-4) is a chemical compound with molecular formula C19H20ClN3O4 and molecular weight 389.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-chloro-4-nitrophenyl)-3-(2-ethylbutanoylamino)benzamide
Also Known As: N-(2-chloro-4-nitrophenyl)-3-(2-ethylbutanoylamino)benzamide, N-(2-chloro-4-nitrophenyl)-3-[(2-ethylbutanoyl)amino]benzamide, N-{3-[N-(2-chloro-4-nitrophenyl)carbamoyl]phenyl}-2-ethylbutanamide
| Molecular Formula | C19H20ClN3O4 |
|---|---|
| Molecular Weight | 389.11 g/mol |
| LogP | 4.8752 |
| Topological Polar Surface Area | 101.34 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 389.11423 |
| Heavy Atoms | 27 |
| Complexity | 865.7833 |
Chemical Identifiers
| CAS Number | 825596-99-4 |
|---|---|
| SMILES | CCC(CC)C(=O)NC1=CC=CC(=C1)C(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])Cl |
Product Overview
N-(2-chloro-4-nitrophenyl)-3-(2-ethylbutanoylamino)benzamide (CAS 825596-99-4), with molecular formula C19H20ClN3O4 and molecular weight 389.11 g/mol. IUPAC: N-(2-chloro-4-nitrophenyl)-3-(2-ethylbutanoylamino)benzamide.
Chemical Property Profile of N-(2-chloro-4-nitrophenyl)-3-(2-ethylbutanoylamino)benzamide
Property Insights of N-(2-chloro-4-nitrophenyl)-3-(2-ethylbutanoylamino)benzamide
The XLogP value of 4.8752 indicates that N-(2-chloro-4-nitrophenyl)-3-(2-ethylbutanoylamino)benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 101.34 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(2-chloro-4-nitrophenyl)-3-(2-ethylbutanoylamino)benzamide. Following Lipinski's Rule of Five, N-(2-chloro-4-nitrophenyl)-3-(2-ethylbutanoylamino)benzamide has 2 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-(2-chloro-4-nitrophenyl)-3-(2-ethylbutanoylamino)benzamide?
The CAS number of N-(2-chloro-4-nitrophenyl)-3-(2-ethylbutanoylamino)benzamide is 825596-99-4.
What is the molecular formula of N-(2-chloro-4-nitrophenyl)-3-(2-ethylbutanoylamino)benzamide?
The molecular formula of N-(2-chloro-4-nitrophenyl)-3-(2-ethylbutanoylamino)benzamide is C19H20ClN3O4.
What is the molecular weight of N-(2-chloro-4-nitrophenyl)-3-(2-ethylbutanoylamino)benzamide?
The molecular weight of N-(2-chloro-4-nitrophenyl)-3-(2-ethylbutanoylamino)benzamide is 389.11 g/mol.
Where can I buy N-(2-chloro-4-nitrophenyl)-3-(2-ethylbutanoylamino)benzamide?
You can request a quote for N-(2-chloro-4-nitrophenyl)-3-(2-ethylbutanoylamino)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2-chloro-4-nitrophenyl)-3-(2-ethylbutanoylamino)benzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(2-chloro-4-nitrophenyl)-3-(2-ethylbutanoylamino)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.