3-((4-Nitrobenzyl)thio)-5,6-diphenyl-1,2,4-triazine structure

3-((4-Nitrobenzyl)thio)-5,6-diphenyl-1,2,4-triazine

3-[(4-nitrophenyl)methylsulfanyl]-5,6-diphenyl-1,2,4-triazine

Also Known As: CBMicro_048570|Oprea1_164739|Oprea1_707382|3-((4-Nitrobenzyl)thio)-5,6-diphenyl-1,2,4-triazine|BAS 01127296|BIM-0048467.P001|3-[(4-nitrobenzyl)thio]-5,6-diphenyl-1,2,4-triazine|3-[(4-nitrophenyl)methylsulfanyl]-5,6-diphenyl-1,2,4-triazine|SR-01000426817-1|3-(4-Nitro-benzylsulfanyl)-5,6-diphenyl-[1,2,4]triazine|3-{[(4-NITROPHENYL)METHYL]SULFANYL}-5,6-DIPHENYL-1,2,4-TRIAZINE|648-967-3

CAS: 5808-50-4
Molecular Formula C22H16N4O2S
Molecular Weight 400.0994 g/mol
LogP 5.4061
Topological Polar Surface Area 81.81 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 6
Rotatable Bonds 6
Exact Mass 400.0994
Monoisotopic Mass 400.0994
Heavy Atoms 29
Complexity 1120.6345

Chemical Identifiers

CAS Number 5808-50-4
SMILES C1=CC=C(C=C1)C2=C(N=NC(=N2)SCC3=CC=C(C=C3)[N+](=O)[O-])C4=CC=CC=C4

Product Overview

3-((4-Nitrobenzyl)thio)-5,6-diphenyl-1,2,4-triazine (CAS 5808-50-4), with molecular formula C22H16N4O2S and molecular weight 400.0994 g/mol. IUPAC: 3-[(4-nitrophenyl)methylsulfanyl]-5,6-diphenyl-1,2,4-triazine.

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3-((4-Nitrobenzyl)thio)-5,6-diphenyl-1,2,4-triazine is a custom synthesis product. We offer services from milligram to kilogram scale.

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