2-chloro-N-[[4-[(3-chlorobenzoyl)amino]phenyl]carbamothioyl]benzamide
TL;DR: 2-chloro-N-[[4-[(3-chlorobenzoyl)amino]phenyl]carbamothioyl]benzamide (CAS 425654-80-4) is a chemical compound with molecular formula C21H15Cl2N3O2S and molecular weight 443.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-N-[[4-[(3-chlorobenzoyl)amino]phenyl]carbamothioyl]benzamide
Also Known As: 2-chloro-N-[[4-[(3-chlorobenzoyl)amino]phenyl]carbamothioyl]benzamide, 2-chloro-N-[(4-{[(3-chlorophenyl)carbonyl]amino}phenyl)carbamothioyl]benzamide, 2-chloro-N-[({4-[(3-chlorobenzoyl)amino]phenyl}amino)carbonothioyl]benzamide
| Molecular Formula | C21H15Cl2N3O2S |
|---|---|
| Molecular Weight | 443.03 g/mol |
| LogP | 5.3725 |
| Topological Polar Surface Area | 70.23 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 443.0262 |
| Heavy Atoms | 29 |
| Complexity | 1071.5311 |
Chemical Identifiers
| CAS Number | 425654-80-4 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C(=O)NC(=S)NC2=CC=C(C=C2)NC(=O)C3=CC(=CC=C3)Cl)Cl |
Product Overview
2-chloro-N-[[4-[(3-chlorobenzoyl)amino]phenyl]carbamothioyl]benzamide (CAS 425654-80-4), with molecular formula C21H15Cl2N3O2S and molecular weight 443.03 g/mol. IUPAC: 2-chloro-N-[[4-[(3-chlorobenzoyl)amino]phenyl]carbamothioyl]benzamide.
Chemical Property Profile of 2-chloro-N-[[4-[(3-chlorobenzoyl)amino]phenyl]carbamothioyl]benzamide
Property Insights of 2-chloro-N-[[4-[(3-chlorobenzoyl)amino]phenyl]carbamothioyl]benzamide
The XLogP value of 5.3725 indicates that 2-chloro-N-[[4-[(3-chlorobenzoyl)amino]phenyl]carbamothioyl]benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.23 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-chloro-N-[[4-[(3-chlorobenzoyl)amino]phenyl]carbamothioyl]benzamide. Following Lipinski's Rule of Five, 2-chloro-N-[[4-[(3-chlorobenzoyl)amino]phenyl]carbamothioyl]benzamide has 3 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-chloro-N-[[4-[(3-chlorobenzoyl)amino]phenyl]carbamothioyl]benzamide?
The CAS number of 2-chloro-N-[[4-[(3-chlorobenzoyl)amino]phenyl]carbamothioyl]benzamide is 425654-80-4.
What is the molecular formula of 2-chloro-N-[[4-[(3-chlorobenzoyl)amino]phenyl]carbamothioyl]benzamide?
The molecular formula of 2-chloro-N-[[4-[(3-chlorobenzoyl)amino]phenyl]carbamothioyl]benzamide is C21H15Cl2N3O2S.
What is the molecular weight of 2-chloro-N-[[4-[(3-chlorobenzoyl)amino]phenyl]carbamothioyl]benzamide?
The molecular weight of 2-chloro-N-[[4-[(3-chlorobenzoyl)amino]phenyl]carbamothioyl]benzamide is 443.03 g/mol.
Where can I buy 2-chloro-N-[[4-[(3-chlorobenzoyl)amino]phenyl]carbamothioyl]benzamide?
You can request a quote for 2-chloro-N-[[4-[(3-chlorobenzoyl)amino]phenyl]carbamothioyl]benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-chloro-N-[[4-[(3-chlorobenzoyl)amino]phenyl]carbamothioyl]benzamide?
Yes, KEHONG BIO provides custom synthesis services for 2-chloro-N-[[4-[(3-chlorobenzoyl)amino]phenyl]carbamothioyl]benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.