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Home > Encyclopedia > 4-(4-chlorophenyl)-3-(4-methoxyphenyl)-5-[(4-nitrophenyl)methylsulfanyl]-1,2,4-triazole

4-(4-chlorophenyl)-3-(4-methoxyphenyl)-5-[(4-nitrophenyl)methylsulfanyl]-1,2,4-triazole

4-(4-chlorophenyl)-3-(4-methoxyphenyl)-5-[(4-nitrophenyl)methylsulfanyl]-1,2,4-triazole structure

4-(4-chlorophenyl)-3-(4-methoxyphenyl)-5-[(4-nitrophenyl)methylsulfanyl]-1,2,4-triazole 

structure
  • CAS No:

    618880-63-0

  • Formula:

    C22H17ClN4O3S

  • Chemical Name:

    4-(4-chlorophenyl)-3-(4-methoxyphenyl)-5-[(4-nitrophenyl)methylsulfanyl]-1,2,4-triazole

  • Synonyms:

    4-(4-chlorophenyl)-3-(4-methoxyphenyl)-5-[(4-nitrobenzyl)sulfanyl]-4H-1,2,4-triazole;618880-63-0;ZINC1862509;STK592227;AKOS005514317;MCULE-8980310142;ST50414494;4-(4-Chlorophenyl)-3-(4-methoxyphenyl)-5-((4-nitrobenzyl)thio)-4H-1,2,4-triazole;1-{4-(4-chlorophenyl)-5-[(4-nitrophenyl)methylthio](1,2,4-triazol-3-yl)}-4-met hoxybenzene

4-(4-chlorophenyl)-3-(4-methoxyphenyl)-5-[(4-nitrophenyl)methylsulfanyl]-1,2,4-triazole Basic Attributes

452.9 g/mol

452.0709893 g/mol

Characteristics

111 Ų

Safety Information

|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P273, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:452.9
XLogP3:5.5
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:6
Exact Mass:452.0709893
Monoisotopic Mass:452.0709893
Topological Polar Surface Area:111
Heavy Atom Count:31
Complexity:574
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of 4-(4-chlorophenyl)-3-(4-methoxyphenyl)-5-[(4-nitrophenyl)methylsulfanyl]-1,2,4-triazole

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