4-Chloro-3-[[2-(2,4-dimethylphenoxy)acetyl]carbamothioylamino]benzoic acid

Base Information

• Chemical Name: 4-Chloro-3-[[2-(2,4-dimethylphenoxy)acetyl]carbamothioylamino]benzoic acid
• CAS No.: 532388-20-8
• Molecular Formula: C18H17ClN2O4S
• Molecular Weight: 392.86
• DSSTox Substance ID: DTXSID10403806
• Wikidata: Q82207621
• Mol file: 532388-20-8.mol

Synonyms:532388-20-8;4-chloro-3-[[2-(2,4-dimethylphenoxy)acetyl]carbamothioylamino]benzoic acid;DTXSID10403806;AKOS000294246

Chemical Property of 4-Chloro-3-[[2-(2,4-dimethylphenoxy)acetyl]carbamothioylamino]benzoic acid

Chemical Property:

• PSA: 130.28000
• LogP: 4.60780
• XLogP3: 4.4
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 5
• Exact Mass: 392.0597559
• Heavy Atom Count: 26
• Complexity: 533

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC(=C(C=C1)OCC(=O)NC(=S)NC2=C(C=CC(=C2)C(=O)O)Cl)C