![N-[[3-[(2-chlorobenzoyl)amino]phenyl]carbamothioyl]-2-nitrobenzamide structure](/static/products/4284/428483-53-8.webp)
N-[[3-[(2-chlorobenzoyl)amino]phenyl]carbamothioyl]-2-nitrobenzamide
TL;DR: N-[[3-[(2-chlorobenzoyl)amino]phenyl]carbamothioyl]-2-nitrobenzamide (CAS 428483-53-8) is a chemical compound with molecular formula C21H15ClN4O4S and molecular weight 454.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[3-[(2-chlorobenzoyl)amino]phenyl]carbamothioyl]-2-nitrobenzamide
Also Known As: AB00108637-01, N-[[3-[(2-chlorobenzoyl)amino]phenyl]carbamothioyl]-2-nitrobenzamide, 2-chloro-N-[3-({[(2-nitrophenyl)carbonyl]carbamothioyl}amino)phenyl]benzamide, N-[({3-[(2-chlorophenyl)carbonylamino]phenyl}amino)thioxomethyl](2-nitrophenyl )carboxamide
| Molecular Formula | C21H15ClN4O4S |
|---|---|
| Molecular Weight | 454.05 g/mol |
| LogP | 4.6273 |
| Topological Polar Surface Area | 113.37 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 454.05026 |
| Heavy Atoms | 31 |
| Complexity | 1185.3011 |
Chemical Identifiers
| CAS Number | 428483-53-8 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C(=O)NC(=S)NC2=CC=CC(=C2)NC(=O)C3=CC=CC=C3Cl)[N+](=O)[O-] |
Product Overview
N-[[3-[(2-chlorobenzoyl)amino]phenyl]carbamothioyl]-2-nitrobenzamide (CAS 428483-53-8), with molecular formula C21H15ClN4O4S and molecular weight 454.05 g/mol. IUPAC: N-[[3-[(2-chlorobenzoyl)amino]phenyl]carbamothioyl]-2-nitrobenzamide.
Chemical Property Profile of N-[[3-[(2-chlorobenzoyl)amino]phenyl]carbamothioyl]-2-nitrobenzamide
Property Insights of N-[[3-[(2-chlorobenzoyl)amino]phenyl]carbamothioyl]-2-nitrobenzamide
The XLogP value of 4.6273 indicates that N-[[3-[(2-chlorobenzoyl)amino]phenyl]carbamothioyl]-2-nitrobenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 113.37 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[[3-[(2-chlorobenzoyl)amino]phenyl]carbamothioyl]-2-nitrobenzamide. Following Lipinski's Rule of Five, N-[[3-[(2-chlorobenzoyl)amino]phenyl]carbamothioyl]-2-nitrobenzamide has 3 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-[[3-[(2-chlorobenzoyl)amino]phenyl]carbamothioyl]-2-nitrobenzamide?
The CAS number of N-[[3-[(2-chlorobenzoyl)amino]phenyl]carbamothioyl]-2-nitrobenzamide is 428483-53-8.
What is the molecular formula of N-[[3-[(2-chlorobenzoyl)amino]phenyl]carbamothioyl]-2-nitrobenzamide?
The molecular formula of N-[[3-[(2-chlorobenzoyl)amino]phenyl]carbamothioyl]-2-nitrobenzamide is C21H15ClN4O4S.
What is the molecular weight of N-[[3-[(2-chlorobenzoyl)amino]phenyl]carbamothioyl]-2-nitrobenzamide?
The molecular weight of N-[[3-[(2-chlorobenzoyl)amino]phenyl]carbamothioyl]-2-nitrobenzamide is 454.05 g/mol.
Where can I buy N-[[3-[(2-chlorobenzoyl)amino]phenyl]carbamothioyl]-2-nitrobenzamide?
You can request a quote for N-[[3-[(2-chlorobenzoyl)amino]phenyl]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-[[3-[(2-chlorobenzoyl)amino]phenyl]carbamothioyl]-2-nitrobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-[[3-[(2-chlorobenzoyl)amino]phenyl]carbamothioyl]-2-nitrobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.