![N-[[[2-(2,4-dichlorophenoxy)acetyl]amino]carbamothioyl]-2-nitrobenzamide structure](/static/products/501/501106-20-3.png)
N-[[[2-(2,4-dichlorophenoxy)acetyl]amino]carbamothioyl]-2-nitrobenzamide
TL;DR: N-[[[2-(2,4-dichlorophenoxy)acetyl]amino]carbamothioyl]-2-nitrobenzamide (CAS 501106-20-3) is a chemical compound with molecular formula C16H12Cl2N4O5S and molecular weight 441.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[[2-(2,4-dichlorophenoxy)acetyl]amino]carbamothioyl]-2-nitrobenzamide
Also Known As: AN-329/41563397, N-({2-[(2,4-dichlorophenoxy)acetyl]hydrazino}carbonothioyl)-2-nitrobenzamide, N-({2-[(2,4-dichlorophenoxy)acetyl]hydrazino}carbothioyl)-2-nitrobenzamide, N-[[[2-(2,4-dichlorophenoxy)acetyl]amino]carbamothioyl]-2-nitrobenzamide, N-({2-[(2,4-dichlorophenoxy)acetyl]hydrazinyl}carbonothioyl)-2-nitrobenzamide
| Molecular Formula | C16H12Cl2N4O5S |
|---|---|
| Molecular Weight | 441.99 g/mol |
| LogP | 2.6161 |
| Topological Polar Surface Area | 122.6 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 441.99054 |
| Heavy Atoms | 28 |
| Complexity | 941.0007 |
Chemical Identifiers
| CAS Number | 501106-20-3 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C(=O)NC(=S)NNC(=O)COC2=C(C=C(C=C2)Cl)Cl)[N+](=O)[O-] |
Product Overview
N-[[[2-(2,4-dichlorophenoxy)acetyl]amino]carbamothioyl]-2-nitrobenzamide (CAS 501106-20-3), with molecular formula C16H12Cl2N4O5S and molecular weight 441.99 g/mol. IUPAC: N-[[[2-(2,4-dichlorophenoxy)acetyl]amino]carbamothioyl]-2-nitrobenzamide.
Chemical Property Profile of N-[[[2-(2,4-dichlorophenoxy)acetyl]amino]carbamothioyl]-2-nitrobenzamide
Property Insights of N-[[[2-(2,4-dichlorophenoxy)acetyl]amino]carbamothioyl]-2-nitrobenzamide
The XLogP value of 2.6161 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[[[2-(2,4-dichlorophenoxy)acetyl]amino]carbamothioyl]-2-nitrobenzamide. The TPSA of 122.6 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[[[2-(2,4-dichlorophenoxy)acetyl]amino]carbamothioyl]-2-nitrobenzamide. Following Lipinski's Rule of Five, N-[[[2-(2,4-dichlorophenoxy)acetyl]amino]carbamothioyl]-2-nitrobenzamide has 3 hydrogen bond donor(s) and 6 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-(2,4-dichlorophenoxy)acetyl]amino]carbamothioyl]-2-nitrobenzamide?
The CAS number of N-[[[2-(2,4-dichlorophenoxy)acetyl]amino]carbamothioyl]-2-nitrobenzamide is 501106-20-3.
What is the molecular formula of N-[[[2-(2,4-dichlorophenoxy)acetyl]amino]carbamothioyl]-2-nitrobenzamide?
The molecular formula of N-[[[2-(2,4-dichlorophenoxy)acetyl]amino]carbamothioyl]-2-nitrobenzamide is C16H12Cl2N4O5S.
What is the molecular weight of N-[[[2-(2,4-dichlorophenoxy)acetyl]amino]carbamothioyl]-2-nitrobenzamide?
The molecular weight of N-[[[2-(2,4-dichlorophenoxy)acetyl]amino]carbamothioyl]-2-nitrobenzamide is 441.99 g/mol.
Where can I buy N-[[[2-(2,4-dichlorophenoxy)acetyl]amino]carbamothioyl]-2-nitrobenzamide?
You can request a quote for N-[[[2-(2,4-dichlorophenoxy)acetyl]amino]carbamothioyl]-2-nitrobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[[[2-(2,4-dichlorophenoxy)acetyl]amino]carbamothioyl]-2-nitrobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-[[[2-(2,4-dichlorophenoxy)acetyl]amino]carbamothioyl]-2-nitrobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.