3H-1,2,4-Triazole-3-thione, 2,4-dihydro-4-(4-chlorophenyl)-5-((2-methyl-1H-indol-3-yl)methyl)-

Base Information

Chemical Name:3H-1,2,4-Triazole-3-thione, 2,4-dihydro-4-(4-chlorophenyl)-5-((2-methyl-1H-indol-3-yl)methyl)-
CAS No.:54649-03-5
Molecular Formula:C18H15ClN4S
Molecular Weight:354.8565
Hs Code.:
DSSTox Substance ID:DTXSID80203097
Wikidata:Q83076458

Synonyms:BRN 4546817;3H-1,2,4-Triazole-3-thione, 2,4-dihydro-4-(4-chlorophenyl)-5-((2-methyl-1H-indol-3-yl)methyl)-;54649-03-5;2,4-Dihydro-4-(4-chlorophenyl)-5-((2-methyl-1H-indol-3-yl)methyl)-3H-1,2,4-triazole-3-thione;C18H15ClN4S;DTXSID80203097;LS-156187

Suppliers and Price of 3H-1,2,4-Triazole-3-thione, 2,4-dihydro-4-(4-chlorophenyl)-5-((2-methyl-1H-indol-3-yl)methyl)-

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

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Chemical Property of 3H-1,2,4-Triazole-3-thione, 2,4-dihydro-4-(4-chlorophenyl)-5-((2-methyl-1H-indol-3-yl)methyl)-

Chemical Property:

Vapor Pressure:4.28E-12mmHg at 25°C
Boiling Point:548.8°C at 760 mmHg
Flash Point:285.7°C
Density:1.41g/cm³
XLogP3:4.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:354.0705954
Heavy Atom Count:24
Complexity:517

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1=C(C2=CC=CC=C2N1)CC3=NNC(=S)N3C4=CC=C(C=C4)Cl

Technology Process of 3H-1,2,4-Triazole-3-thione, 2,4-dihydro-4-(4-chlorophenyl)-5-((2-methyl-1H-indol-3-yl)methyl)-

There total 7 articles about 3H-1,2,4-Triazole-3-thione, 2,4-dihydro-4-(4-chlorophenyl)-5-((2-methyl-1H-indol-3-yl)methyl)- which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 83.0%

: 54648-93-0
1-(2-methylindolyl-3-acetyl)-4-p-chlorophenylthiosemicarbazide

: 54649-03-5
3-mercapto-4-p-chlorophenyl-5-<3-(2-methylindolyl)methyl>-1,2,4-triazole

Guidance literature:: With potassium hydroxide; In water; for 2h; Heating;

Reference yield:

: 21909-51-3
2-(2-methyl-1H-indol-3-yl)acetohydrazide

: 54649-03-5
3-mercapto-4-p-chlorophenyl-5-<3-(2-methylindolyl)methyl>-1,2,4-triazole

Guidance literature:: Multi-step reaction with 2 steps

1: 89 percent / ethanol / 1 h / Heating

2: 83 percent / KOH / H₂O / 2 h / Heating

With potassium hydroxide; In ethanol; water;

Reference yield:

: 2131-55-7
4-Chlorophenyl isothiocyanate

: 54649-03-5
3-mercapto-4-p-chlorophenyl-5-<3-(2-methylindolyl)methyl>-1,2,4-triazole

Guidance literature:: Multi-step reaction with 2 steps

1: 89 percent / ethanol / 1 h / Heating

2: 83 percent / KOH / H₂O / 2 h / Heating

With potassium hydroxide; In ethanol; water;