(E)-N-((4-((2-hydroxy-3-methyl-5-nitrobenzylidene)amino)phenyl)carbamothioyl)acetamide
TL;DR: (E)-N-((4-((2-hydroxy-3-methyl-5-nitrobenzylidene)amino)phenyl)carbamothioyl)acetamide (CAS 638153-49-8) is a chemical compound with molecular formula C17H16N4O4S and molecular weight 372.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[4-[(2-hydroxy-3-methyl-5-nitrophenyl)methylideneamino]phenyl]carbamothioyl]acetamide
Also Known As: (E)-N-((4-((2-hydroxy-3-methyl-5-nitrobenzylidene)amino)phenyl)carbamothioyl)acetamide, N-[(4-{[(E)-(2-hydroxy-3-methyl-5-nitrophenyl)methylidene]amino}phenyl)carbamothioyl]acetamide, N-[[4-[(5-methyl-3-nitro-6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]phenyl]carbamothioyl]acetamide, N-[[4-[[(E)-(5-methyl-3-nitro-6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]phenyl]carbamothioyl]acetamide
| Molecular Formula | C17H16N4O4S |
|---|---|
| Molecular Weight | 372.09 g/mol |
| LogP | 3.19232 |
| Topological Polar Surface Area | 116.86 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 372.08923 |
| Heavy Atoms | 26 |
| Complexity | 894.38104 |
Chemical Identifiers
| CAS Number | 638153-49-8 |
|---|---|
| SMILES | CC1=CC(=CC(=C1O)C=NC2=CC=C(C=C2)NC(=S)NC(=O)C)[N+](=O)[O-] |
Product Overview
(E)-N-((4-((2-hydroxy-3-methyl-5-nitrobenzylidene)amino)phenyl)carbamothioyl)acetamide (CAS 638153-49-8), with molecular formula C17H16N4O4S and molecular weight 372.09 g/mol. IUPAC: N-[[4-[(2-hydroxy-3-methyl-5-nitrophenyl)methylideneamino]phenyl]carbamothioyl]acetamide.
Chemical Property Profile of (E)-N-((4-((2-hydroxy-3-methyl-5-nitrobenzylidene)amino)phenyl)carbamothioyl)acetamide
Property Insights of (E)-N-((4-((2-hydroxy-3-methyl-5-nitrobenzylidene)amino)phenyl)carbamothioyl)acetamide
The XLogP value of 3.19232 indicates that (E)-N-((4-((2-hydroxy-3-methyl-5-nitrobenzylidene)amino)phenyl)carbamothioyl)acetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 116.86 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-N-((4-((2-hydroxy-3-methyl-5-nitrobenzylidene)amino)phenyl)carbamothioyl)acetamide. Following Lipinski's Rule of Five, (E)-N-((4-((2-hydroxy-3-methyl-5-nitrobenzylidene)amino)phenyl)carbamothioyl)acetamide 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 (E)-N-((4-((2-hydroxy-3-methyl-5-nitrobenzylidene)amino)phenyl)carbamothioyl)acetamide?
The CAS number of (E)-N-((4-((2-hydroxy-3-methyl-5-nitrobenzylidene)amino)phenyl)carbamothioyl)acetamide is 638153-49-8.
What is the molecular formula of (E)-N-((4-((2-hydroxy-3-methyl-5-nitrobenzylidene)amino)phenyl)carbamothioyl)acetamide?
The molecular formula of (E)-N-((4-((2-hydroxy-3-methyl-5-nitrobenzylidene)amino)phenyl)carbamothioyl)acetamide is C17H16N4O4S.
What is the molecular weight of (E)-N-((4-((2-hydroxy-3-methyl-5-nitrobenzylidene)amino)phenyl)carbamothioyl)acetamide?
The molecular weight of (E)-N-((4-((2-hydroxy-3-methyl-5-nitrobenzylidene)amino)phenyl)carbamothioyl)acetamide is 372.09 g/mol.
Where can I buy (E)-N-((4-((2-hydroxy-3-methyl-5-nitrobenzylidene)amino)phenyl)carbamothioyl)acetamide?
You can request a quote for (E)-N-((4-((2-hydroxy-3-methyl-5-nitrobenzylidene)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-((2-hydroxy-3-methyl-5-nitrobenzylidene)amino)phenyl)carbamothioyl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for (E)-N-((4-((2-hydroxy-3-methyl-5-nitrobenzylidene)amino)phenyl)carbamothioyl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.