AC1M1ST9

2-[[5-(1,3-benzodioxol-5-yloxymethyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-1-(4-fluorophenyl)ethanone

Also Known As: 2-((5-((benzo[d][1,3]dioxol-5-yloxy)methyl)-4-phenyl-4H-1,2,4-triazol-3-yl)thio)-1-(4-fluorophenyl)ethanone|F1379-0066|2-[[5-(1,3-benzodioxol-5-yloxymethyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-1-(4-fluorophenyl)ethanone|2({5[(1,3benzodioxol5yloxy)methyl]4phenyl4h1,2,4triazol3yl}thio)1(4fluorophenyl)ethanone|2-({5-[(1,3-benzodioxol-5-yloxy)methyl]-4-phenyl-4H-1,2,4-triazol-3-yl}sulfanyl)-1-(4-fluorophenyl)ethanone|2-({5-[(2H-1,3-BENZODIOXOL-5-YLOXY)METHYL]-4-PHENYL-4H-1,2,4-TRIAZOL-3-YL}SULFANYL)-1-(4-FLUOROPHENYL)ETHAN-1-ONE|2-[5-(2H-benzo[3,4-d]1,3-dioxolan-5-yloxymethyl)-4-phenyl(1,2,4-triazol-3-ylth io)]-1-(4-fluorophenyl)ethan-1-one

Molecular Formula	C24H18FN3O4S
Molecular Weight	463.10022 g/mol
LogP	4.6891
Topological Polar Surface Area	75.47 Ų
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	7
Rotatable Bonds	8
Exact Mass	463.10022
Monoisotopic Mass	463.10022
Heavy Atoms	33
Complexity	1278.8763

Chemical Identifiers

CAS Number	609792-69-0
SMILES	C1OC2=C(O1)C=C(C=C2)OCC3=NN=C(N3C4=CC=CC=C4)SCC(=O)C5=CC=C(C=C5)F