5,7-Bis(trifluoromethyl)-2-(methylthio)pyrazolo[1,5-a]pyrimidine-3-carboxamide

Base Information

• Chemical Name: 5,7-Bis(trifluoromethyl)-2-(methylthio)pyrazolo[1,5-a]pyrimidine-3-carboxamide
• CAS No.: 175203-36-8
• Molecular Formula: C10H6 F6 N4 O S
• Molecular Weight: 344.24
• Hs Code.: 2933990090
• DSSTox Substance ID: DTXSID90371175
• Wikidata: Q82158434
• ChEMBL ID: CHEMBL1379868
• Mol file: 175203-36-8.mol

Synonyms:175203-36-8;5,7-Bis(trifluoromethyl)-2-(methylthio)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-(Methylthio)-5,7-bis(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-methylsulfanyl-5,7-bis(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;5,7-Bis(trifluoromethyl)-2-(methylthio)pyrazolo-[1,5-a]pyrimidine-3-carboxamide;2-(methylsulfanyl)-5,7-bis(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-(methylthio)-5,7-di(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;Maybridge1_004860;MLS000860760;CHEMBL1379868;HMS555E20;DTXSID90371175;HMS2789L16;MFCD00174394;AKOS015853084;PS-7005;SMR000459544;CS-0448308;FT-0619837;A811860

Chemical Property of 5,7-Bis(trifluoromethyl)-2-(methylthio)pyrazolo[1,5-a]pyrimidine-3-carboxamide

Chemical Property:

• Melting Point: >250°C
• Refractive Index: 1.544
• Boiling Point: °Cat760mmHg
• Flash Point: °C
• PSA: 98.58000
• Density: 1.78g/cm³
• LogP: 3.28800
• XLogP3: 1.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 10
• Rotatable Bond Count: 2
• Exact Mass: 344.01665097
• Heavy Atom Count: 22
• Complexity: 444

Purity/Quality:

98%min ^*data from raw suppliers

5,7-Bis(trifluoromethyl)-2-(methylthio)pyrazolo[1,5-a]pyrimidine-3-carboxamide ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xi

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CSC1=NN2C(=CC(=NC2=C1C(=O)N)C(F)(F)F)C(F)(F)F