N-(4-chloro-2-nitrophenyl)-3-oxo-3-(thiophen-2-yl)propanamide
TL;DR: N-(4-chloro-2-nitrophenyl)-3-oxo-3-(thiophen-2-yl)propanamide (CAS 330158-99-1) is a chemical compound with molecular formula C13H9ClN2O4S and molecular weight 324.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-chloro-2-nitrophenyl)-3-oxo-3-thiophen-2-ylpropanamide
Also Known As: N-(4-chloro-2-nitrophenyl)-3-oxo-3-(thiophen-2-yl)propanamide, N-(4-chloro-2-nitrophenyl)-3-oxo-3-thiophen-2-ylpropanamide
| Molecular Formula | C13H9ClN2O4S |
|---|---|
| Molecular Weight | 324.00 g/mol |
| LogP | 3.5212 |
| Topological Polar Surface Area | 89.31 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 323.99716 |
| Heavy Atoms | 21 |
| Complexity | 700.2018 |
Chemical Identifiers
| CAS Number | 330158-99-1 |
|---|---|
| SMILES | C1=CSC(=C1)C(=O)CC(=O)NC2=C(C=C(C=C2)Cl)[N+](=O)[O-] |
Product Overview
N-(4-chloro-2-nitrophenyl)-3-oxo-3-(thiophen-2-yl)propanamide (CAS 330158-99-1), with molecular formula C13H9ClN2O4S and molecular weight 324.00 g/mol. IUPAC: N-(4-chloro-2-nitrophenyl)-3-oxo-3-thiophen-2-ylpropanamide.
Chemical Property Profile of N-(4-chloro-2-nitrophenyl)-3-oxo-3-(thiophen-2-yl)propanamide
Property Insights of N-(4-chloro-2-nitrophenyl)-3-oxo-3-(thiophen-2-yl)propanamide
The XLogP value of 3.5212 indicates that N-(4-chloro-2-nitrophenyl)-3-oxo-3-(thiophen-2-yl)propanamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.31 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(4-chloro-2-nitrophenyl)-3-oxo-3-(thiophen-2-yl)propanamide. Following Lipinski's Rule of Five, N-(4-chloro-2-nitrophenyl)-3-oxo-3-(thiophen-2-yl)propanamide has 1 hydrogen bond donor(s) and 5 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-(4-chloro-2-nitrophenyl)-3-oxo-3-(thiophen-2-yl)propanamide?
The CAS number of N-(4-chloro-2-nitrophenyl)-3-oxo-3-(thiophen-2-yl)propanamide is 330158-99-1.
What is the molecular formula of N-(4-chloro-2-nitrophenyl)-3-oxo-3-(thiophen-2-yl)propanamide?
The molecular formula of N-(4-chloro-2-nitrophenyl)-3-oxo-3-(thiophen-2-yl)propanamide is C13H9ClN2O4S.
What is the molecular weight of N-(4-chloro-2-nitrophenyl)-3-oxo-3-(thiophen-2-yl)propanamide?
The molecular weight of N-(4-chloro-2-nitrophenyl)-3-oxo-3-(thiophen-2-yl)propanamide is 324.00 g/mol.
Where can I buy N-(4-chloro-2-nitrophenyl)-3-oxo-3-(thiophen-2-yl)propanamide?
You can request a quote for N-(4-chloro-2-nitrophenyl)-3-oxo-3-(thiophen-2-yl)propanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-chloro-2-nitrophenyl)-3-oxo-3-(thiophen-2-yl)propanamide?
Yes, KEHONG BIO provides custom synthesis services for N-(4-chloro-2-nitrophenyl)-3-oxo-3-(thiophen-2-yl)propanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.