AC1O4S37

4-phenyl-3-(5H-[1,2,4]triazino[5,6-b]indol-3-ylsulfanylmethyl)-1H-1,2,4-triazole-5-thione

Also Known As: KS-00003PCV|MS-7229|4-phenyl-3-({5H-[1,2,4]triazino[5,6-b]indol-3-ylsulfanyl}methyl)-4,5-dihydro-1H-1,2,4-triazole-5-thione|4-phenyl-3-(5H-[1,2,4]triazino[5,6-b]indol-3-ylsulfanylmethyl)-1H-1,2,4-triazole-5-thione|4-PHENYL-3-(2,3,6-TRIAZINO[5,4-B]INDOL-3-YLTHIOMETHYL)-1,2,4-TRIAZOLINE-5-THIONE|4-phenyl-3-(1,2,4-triazino[5,6-b]indol-3-ylthiomethyl)-1,2,4-triazoline-5-thio ne|4-PHENYL-5-({5H-[1,2,4]TRIAZINO[5,6-B]INDOL-3-YLSULFANYL}METHYL)-2H-1,2,4-TRIAZOLE-3-THIONE|4-phenyl-5-[(5H-[1,2,4]triazino[5,6-b]indol-3-ylsulfanyl)methyl]-2,4-dihydro-3H-1,2,4-triazole-3-thione

Molecular Formula	C18H13N7S2
Molecular Weight	391.06738 g/mol
LogP	4.04169
Topological Polar Surface Area	88.07 Ų
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	6
Rotatable Bonds	4
Exact Mass	391.06738
Monoisotopic Mass	391.06738
Heavy Atoms	27
Complexity	1303.8099

Chemical Identifiers

CAS Number	1024582-10-2
SMILES	C1=CC=C(C=C1)N2C(=NNC2=S)CSC3=NC4=C(C5=CC=CC=C5N4)N=N3