N-[2-(Dimethylcarbamoylmethylsulfanyl)benzothiazol-6-YL]-3-phenyl-propanamide

Base Information

• Chemical Name: N-[2-(Dimethylcarbamoylmethylsulfanyl)benzothiazol-6-YL]-3-phenyl-propanamide
• CAS No.: 4845-20-9
• Molecular Formula: C20H21N3O2S2
• Molecular Weight: 399.5296
• DSSTox Substance ID: DTXSID40412204
• Mol file: 4845-20-9.mol

Synonyms:4845-20-9;N-[2-(DIMETHYLCARBAMOYLMETHYLSULFANYL)BENZOTHIAZOL-6-YL]-3-PHENYL-PROPANAMIDE;DTXSID40412204;AKOS005400468;N-(2-{[2-(dimethylamino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-3-phenylpropanamide

Chemical Property of N-[2-(Dimethylcarbamoylmethylsulfanyl)benzothiazol-6-YL]-3-phenyl-propanamide

Chemical Property:

• Density: 1.32g/cm³
• XLogP3: 3.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 7
• Exact Mass: 399.10751927
• Heavy Atom Count: 27
• Complexity: 512

Purity/Quality:

95% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN(C)C(=O)CSC1=NC2=C(S1)C=C(C=C2)NC(=O)CCC3=CC=CC=C3