3-amino-N-[2-chloro-5-(trifluoromethyl)phenyl]-6,7,8,9-tetrahydro-5H-cyclohepta[b]thieno[3,2-e]pyridine-2-carboxamide

Base Information

• Chemical Name: 3-amino-N-[2-chloro-5-(trifluoromethyl)phenyl]-6,7,8,9-tetrahydro-5H-cyclohepta[b]thieno[3,2-e]pyridine-2-carboxamide
• CAS No.: 400864-42-8
• Molecular Formula: C20H17ClF3N3OS
• Molecular Weight: 439.9
• European Community (EC) Number: 648-675-6
• ChEMBL ID: CHEMBL3759736
• Mol file: 400864-42-8.mol

Synonyms:3-amino-N-[2-chloro-5-(trifluoromethyl)phenyl]-6,7,8,9-tetrahydro-5H-cyclohepta[b]thieno[3,2-e]pyridine-2-carboxamide;CHEMBL3759736;AKOS001643164;EU-0076242;AN-919/15231431;SR-01000475364;SR-01000475364-1;6-amino-N-[2-chloro-5-(trifluoromethyl)phenyl]-4-thia-2-azatricyclo[7.5.0.03,7]tetradeca-1,3(7),5,8-tetraene-5-carboxamide

Chemical Property of 3-amino-N-[2-chloro-5-(trifluoromethyl)phenyl]-6,7,8,9-tetrahydro-5H-cyclohepta[b]thieno[3,2-e]pyridine-2-carboxamide

Chemical Property:

• XLogP3: 6.5
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 2
• Exact Mass: 439.0732955
• Heavy Atom Count: 29
• Complexity: 610

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1CCC2=CC3=C(N=C2CC1)SC(=C3N)C(=O)NC4=C(C=CC(=C4)C(F)(F)F)Cl