AC1LPTOL

2-[[4-(4-fluorophenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanyl]-1-phenylethanone

Also Known As: CBKinase1_003500|CBKinase1_015900|J1.656.225D|BRD-K18559654-001-01-7|2-[[4-(4-fluorophenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanyl]-1-phenylethanone|2-{[4-(4-fluorophenyl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-phenylethanone|2-[[4-(4-fluorophenyl)-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]-1-phenyl-ethanone|4-(4-Fluorophenyl)-5-(4-pyridinyl)-3-(benzoylmethylthio)-4H-1,2,4-triazol|alpha-[[4-(4-Fluorophenyl)-5-(4-pyridinyl)-4H-1,2,4-triazole-3-yl]thio]acetophenone|2-{[4-(4-fluorophenyl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-phenylethan-1-one

Molecular Formula	C21H15FN4OS
Molecular Weight	390.09506 g/mol
LogP	4.4434
Topological Polar Surface Area	60.67 Ų
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	5
Rotatable Bonds	6
Exact Mass	390.09506
Monoisotopic Mass	390.09506
Heavy Atoms	28
Complexity	1082.6158

Chemical Identifiers

CAS Number	333791-75-6
SMILES	C1=CC=C(C=C1)C(=O)CSC2=NN=C(N2C3=CC=C(C=C3)F)C4=CC=NC=C4