(E)-N-((4-((3-bromo-5-(2-chlorobenzyl)-2-hydroxybenzylidene)amino)phenyl)carbamothioyl)acetamide
TL;DR: (E)-N-((4-((3-bromo-5-(2-chlorobenzyl)-2-hydroxybenzylidene)amino)phenyl)carbamothioyl)acetamide (CAS 638153-51-2) is a chemical compound with molecular formula C23H19BrClN3O2S and molecular weight 515.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[4-[[3-bromo-5-[(2-chlorophenyl)methyl]-2-hydroxyphenyl]methylideneamino]phenyl]carbamothioyl]acetamide
Also Known As: (E)-N-((4-((3-bromo-5-(2-chlorobenzyl)-2-hydroxybenzylidene)amino)phenyl)carbamothioyl)acetamide, N-[[4-[[(E)-[5-bromo-3-[(2-chlorophenyl)methyl]-6-oxocyclohexa-2,4-dien-1-ylidene]methyl]amino]phenyl]carbamothioyl]acetamide, N-[[4-[[5-bromo-3-[(2-chlorophenyl)methyl]-6-oxocyclohexa-2,4-dien-1-ylidene]methylamino]phenyl]carbamothioyl]acetamide, N-{[4-({(E)-[3-bromo-5-(2-chlorobenzyl)-2-hydroxyphenyl]methylidene}amino)phenyl]carbamothioyl}acetamide
| Molecular Formula | C23H19BrClN3O2S |
|---|---|
| Molecular Weight | 515.01 g/mol |
| LogP | 5.9824 |
| Topological Polar Surface Area | 73.72 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 515.007 |
| Heavy Atoms | 31 |
| Complexity | 1150.0586 |
Chemical Identifiers
| CAS Number | 638153-51-2 |
|---|---|
| SMILES | CC(=O)NC(=S)NC1=CC=C(C=C1)N=CC2=C(C(=CC(=C2)CC3=CC=CC=C3Cl)Br)O |
Product Overview
(E)-N-((4-((3-bromo-5-(2-chlorobenzyl)-2-hydroxybenzylidene)amino)phenyl)carbamothioyl)acetamide (CAS 638153-51-2), with molecular formula C23H19BrClN3O2S and molecular weight 515.01 g/mol. IUPAC: N-[[4-[[3-bromo-5-[(2-chlorophenyl)methyl]-2-hydroxyphenyl]methylideneamino]phenyl]carbamothioyl]acetamide.
Chemical Property Profile of (E)-N-((4-((3-bromo-5-(2-chlorobenzyl)-2-hydroxybenzylidene)amino)phenyl)carbamothioyl)acetamide
Property Insights of (E)-N-((4-((3-bromo-5-(2-chlorobenzyl)-2-hydroxybenzylidene)amino)phenyl)carbamothioyl)acetamide
The XLogP value of 5.9824 indicates that (E)-N-((4-((3-bromo-5-(2-chlorobenzyl)-2-hydroxybenzylidene)amino)phenyl)carbamothioyl)acetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.72 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-N-((4-((3-bromo-5-(2-chlorobenzyl)-2-hydroxybenzylidene)amino)phenyl)carbamothioyl)acetamide. Following Lipinski's Rule of Five, (E)-N-((4-((3-bromo-5-(2-chlorobenzyl)-2-hydroxybenzylidene)amino)phenyl)carbamothioyl)acetamide has 3 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (E)-N-((4-((3-bromo-5-(2-chlorobenzyl)-2-hydroxybenzylidene)amino)phenyl)carbamothioyl)acetamide?
The CAS number of (E)-N-((4-((3-bromo-5-(2-chlorobenzyl)-2-hydroxybenzylidene)amino)phenyl)carbamothioyl)acetamide is 638153-51-2.
What is the molecular formula of (E)-N-((4-((3-bromo-5-(2-chlorobenzyl)-2-hydroxybenzylidene)amino)phenyl)carbamothioyl)acetamide?
The molecular formula of (E)-N-((4-((3-bromo-5-(2-chlorobenzyl)-2-hydroxybenzylidene)amino)phenyl)carbamothioyl)acetamide is C23H19BrClN3O2S.
What is the molecular weight of (E)-N-((4-((3-bromo-5-(2-chlorobenzyl)-2-hydroxybenzylidene)amino)phenyl)carbamothioyl)acetamide?
The molecular weight of (E)-N-((4-((3-bromo-5-(2-chlorobenzyl)-2-hydroxybenzylidene)amino)phenyl)carbamothioyl)acetamide is 515.01 g/mol.
Where can I buy (E)-N-((4-((3-bromo-5-(2-chlorobenzyl)-2-hydroxybenzylidene)amino)phenyl)carbamothioyl)acetamide?
You can request a quote for (E)-N-((4-((3-bromo-5-(2-chlorobenzyl)-2-hydroxybenzylidene)amino)phenyl)carbamothioyl)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-N-((4-((3-bromo-5-(2-chlorobenzyl)-2-hydroxybenzylidene)amino)phenyl)carbamothioyl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for (E)-N-((4-((3-bromo-5-(2-chlorobenzyl)-2-hydroxybenzylidene)amino)phenyl)carbamothioyl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.