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Home > Encyclopedia > 3-[[5-(4-chlorophenyl)-4-(3-ethoxypropyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-1,2,3-benzotriazin-4-one

3-[[5-(4-chlorophenyl)-4-(3-ethoxypropyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-1,2,3-benzotriazin-4-one

3-[[5-(4-chlorophenyl)-4-(3-ethoxypropyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-1,2,3-benzotriazin-4-one structure

3-[[5-(4-chlorophenyl)-4-(3-ethoxypropyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-1,2,3-benzotriazin-4-one 

structure
  • CAS No:

    727691-78-3

  • Formula:

    C21H21ClN6O2S

  • Chemical Name:

    3-[[5-(4-chlorophenyl)-4-(3-ethoxypropyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-1,2,3-benzotriazin-4-one

  • Synonyms:

    ZINC3361980;AKOS033417268;MCULE-9496777338;Z15453301;3-({[5-(4-chlorophenyl)-4-(3-ethoxypropyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-3,4-dihydro-1,2,3-benzotriazin-4-one;727691-78-3

3-[[5-(4-chlorophenyl)-4-(3-ethoxypropyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-1,2,3-benzotriazin-4-one Basic Attributes

456.9 g/mol

456.1135228 g/mol

Characteristics

110 Ų

Computed Properties

Molecular Weight:456.9
XLogP3:4.5
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:9
Exact Mass:456.1135228
Monoisotopic Mass:456.1135228
Topological Polar Surface Area:110
Heavy Atom Count:31
Complexity:621
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of 3-[[5-(4-chlorophenyl)-4-(3-ethoxypropyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-1,2,3-benzotriazin-4-one

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