N-[(3,4-dichlorophenyl)carbamothioyl]-3-nitro-benzamide

Base Information

• Chemical Name: N-[(3,4-dichlorophenyl)carbamothioyl]-3-nitro-benzamide
• CAS No.: 501679-18-1
• Molecular Formula: C14H9Cl2N3O3S
• NSC Number: 213692
• DSSTox Substance ID: DTXSID00388259

Synonyms:NSC213692;501679-18-1;N-[(3,4-dichlorophenyl)carbamothioyl]-3-nitro-benzamide;DTXSID00388259;AKOS003420191;NSC-213692;N-(3,4-dichlorophenyl)-N'-(3-nitrobenzoyl)thiourea;N-(3,4-Dichlorophenyl)-N'-(3-(hydroxy(oxido)amino)benzoyl)thiourea

Chemical Property of N-[(3,4-dichlorophenyl)carbamothioyl]-3-nitro-benzamide

Chemical Property:

• XLogP3: 5
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 368.9741677
• Heavy Atom Count: 23
• Complexity: 475

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)NC(=S)NC2=CC(=C(C=C2)Cl)Cl

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