252977-51-8
7-tert-butyl-6-[(2-ethyl-1,2,4-triazol-3-yl)methoxy]-3-(2-fluorophenyl)-[1,2,4]triazolo[4,3-b]pyridazine
Molecular Identity
252977-51-8
7-tert-butyl-6-[(2-ethyl-1,2,4-triazol-3-yl)methoxy]-3-(2-fluorophenyl)-[1,2,4]triazolo[4,3-b]pyridazine
PubChem CID: 9908684
2D Structure
Properties
C20H22FN7O
Molecular Formula
395.40
Molecular Weight
g/mol
395.1870
Exact Mass
Da
3.4
XLogP
Drug-like (Lipinski: < 5)
83
TPSA
Good oral absorption (< 140 A²)
0
H-Bond Donors
7
H-Bond Acceptors
547
Complexity
SMILES
Canonical SMILES
SMILES: Synonyms(20)
252977-51-8MK-0777MK07771FI3KTC550DTXSID101799381,2,4-Triazolo(4,3-b)pyridazine, 7-(1,1-dimethylethyl)-6-((1-ethyl-1H-1,2,4-triazol-5-yl)methoxy)-3-(2-fluorophenyl)-7-(1,1-Dimethylethyl)-(6-(1-ethyl-1H-1,2,4-triazol-5-yl)methoxy)-3-(2-fluorophenyl)-1,2,4-triazolo(4,3-b)pyrazine5-({[7-tert-butyl-3-(2-fluorophenyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]oxy}methyl)-1-ethyl-1H-1,2,4-triazole5-(((7-tert-butyl-3-(2-fluorophenyl)-(1,2,4)triazolo(4,3-b)pyridazin-6-yl)oxy)methyl)-1-ethyl-1H-1,2,4-triazole7-(1,1-Dimethylethyl)-6-((1-ethyl-1H-1,2,4-triazol-5-yl)methoxy)-3-(2-fluorophenyl)-1,2,4-triazolo(4,3-b)pyridazine7-(1,1-Dimethylethyl)-6-[(1-ethyl-1H-1,2,4-triazol-5-yl)methoxy]-3-(2-fluorophenyl)-1,2,4-triazolo[4,3-b]pyridazineRefChem:914174DTXCID70102429TPA 023TPA023
Data from PubChem (NCBI)
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