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

Base Information

• Chemical Name: 4-Chloro-3-[(2,3-dichlorobenzoyl)carbamothioylamino]benzoic acid
• CAS No.: 535944-78-6
• Molecular Formula: C15H9Cl3N2O3S
• Molecular Weight: 403.67
• DSSTox Substance ID: DTXSID60403795
• Wikidata: Q82207601
• Mol file: 535944-78-6.mol

Synonyms:4-chloro-3-[(2,3-dichlorobenzoyl)carbamothioylamino]benzoic acid;535944-78-6;DTXSID60403795;AKOS000293992

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

Chemical Property:

• PSA: 121.05000
• LogP: 5.26710
• XLogP3: 4.9
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 401.939946
• Heavy Atom Count: 24
• Complexity: 508

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

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