2-chloro-N-{1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1H-1,2,4-triazol-3-yl}benzenecarboxamide

Base Information

• Chemical Name: 2-chloro-N-{1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1H-1,2,4-triazol-3-yl}benzenecarboxamide
• CAS No.: 321434-03-1
• Molecular Formula: C15H8Cl2F3N5O
• Molecular Weight: 402.2
• DSSTox Substance ID: DTXSID701124513
• Mol file: 321434-03-1.mol

Synonyms:321434-03-1;2-chloro-N-{1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1H-1,2,4-triazol-3-yl}benzenecarboxamide;2-chloro-N-[1-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-1,2,4-triazol-3-yl]benzamide;2-chloro-N-{1-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-1H-1,2,4-triazol-3-yl}benzamide;SCHEMBL17073930;DTXSID701124513;AKOS005082781;1K-055;2-Chloro-N-[1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1H-1,2,4-triazol-3-yl]benzamide

Chemical Property of 2-chloro-N-{1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1H-1,2,4-triazol-3-yl}benzenecarboxamide

Chemical Property:

• PKA: 10.15±0.70(Predicted)
• XLogP3: 4.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 3
• Exact Mass: 401.0057998
• Heavy Atom Count: 26
• Complexity: 512

Purity/Quality:

2-CHLORO-N-(1-(3-CHLORO-5-(TRIFLUOROMETHYL)-2-PYRIDINYL)-1H-1,2,4-TRIAZOL-3-YL)BENZENECARBOXAMIDE 95.00% ^*data from reagent suppliers

Safty Information:

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MSDS Files:

Useful:

• Canonical SMILES: C1=CC=C(C(=C1)C(=O)NC2=NN(C=N2)C3=C(C=C(C=N3)C(F)(F)F)Cl)Cl