3-[(2-methyl-1H-indol-3-yl)methyl]-4-phenyl-1H-1,2,4-triazole-5-thione

Names

[ CAS No. ]:
54648-98-5

[ Name ]:
3-[(2-methyl-1H-indol-3-yl)methyl]-4-phenyl-1H-1,2,4-triazole-5-thione

Chemical & Physical Properties

[ Density]:
1.32g/cm3

[ Boiling Point ]:
512.1ºC at 760 mmHg

[ Molecular Formula ]:
C₁₈H₁₆N₄S

[ Molecular Weight ]:
320.41100

[ Flash Point ]:
263.5ºC

[ Exact Mass ]:
320.11000

[ PSA ]:
85.30000

[ LogP ]:
3.93650

[ Index of Refraction ]:
1.723

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :: XZ5359160

CHEMICAL NAME :: 3H-1,2,4-Triazole-3-thione, 2,4-dihydro-5-((2-methyl-1H-indol-3-yl)methyl)-4-phen yl-

CAS REGISTRY NUMBER :: 54648-98-5

LAST UPDATED :: 199612

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C18-H16-N4-S

MOLECULAR WEIGHT :: 320.44

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Intraperitoneal

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 500 mg/kg

TOXIC EFFECTS :: Behavioral - altered sleep time (including change in righting reflex) Behavioral - ataxia Lungs, Thorax, or Respiration - respiratory depression

REFERENCE :: CNJPAZ Canadian Journal of Pharmaceutical Sciences. (Toronto, Ont., Canada) V.1-16, 1966-81. Discontinued. Volume(issue)/page/year: 9,108,1974

Safety Information

[ HS Code ]:
2933990090

Synthetic Route

Click to get detail synthetic route

Customs

[ HS Code ]: 2933990090

[ Summary ]:
2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%