AC1Q2KQI

3-(3-chlorophenyl)-4-(4-methylphenyl)-5-[(E)-3-phenylprop-2-enyl]sulfanyl-1,2,4-triazole

Also Known As: 3-(3-chlorophenyl)-4-(4-methylphenyl)-5-{[(2E)-3-phenylprop-2-en-1-yl]sulfanyl}-4H-1,2,4-triazole|3-(3-chlorophenyl)-5-(cinnamylthio)-4-(p-tolyl)-4H-1,2,4-triazole|3-(3-chlorophenyl)-5-cinnamylsulfanyl-4-(4-methylphenyl)-1,2,4-triazole|3-((2E)-3-phenylprop-2-enylthio)-5-(3-chlorophenyl)-4-(4-methylphenyl)-1,2,4-t riazole|3-(3-chlorophenyl)-4-(4-methylphenyl)-5-[(E)-3-phenylprop-2-enyl]sulfanyl-1,2,4-triazole

Molecular Formula	C24H20ClN3S
Molecular Weight	417.10666 g/mol
LogP	6.70162
Topological Polar Surface Area	30.71 Ų
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	3
Rotatable Bonds	6
Exact Mass	417.10666
Monoisotopic Mass	417.10666
Heavy Atoms	29
Complexity	1118.5931

Chemical Identifiers

CAS Number	896076-76-9
SMILES	CC1=CC=C(C=C1)N2C(=NN=C2SC/C=C/C3=CC=CC=C3)C4=CC(=CC=C4)Cl