 Home > Encyclopedia > 3-[[4-(4-methylphenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanylmethyl]-6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazole

3-[[4-(4-methylphenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanylmethyl]-6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazole

3-[[4-(4-methylphenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanylmethyl]-6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazole structure

CAS No:
730242-31-6
Formula:
C21H20N6S
Chemical Name:
3-[[4-(4-methylphenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanylmethyl]-6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazole
Synonyms:
SMR000062558;MLS000048498;MLS002633356;CHEMBL1375964;HMS1766B03;HMS2339K16;ZINC3293252;AKOS034464417;MCULE-8759945998;Z56897975;4-(4-methylphenyl)-3-phenyl-5-[({5H,6H,7H-pyrrolo[2,1-c][1,2,4]triazol-3-yl}methyl)sulfanyl]-4H-1,2,4-triazole;730242-31-6

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3-[[4-(4-methylphenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanylmethyl]-6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazole Basic Attributes

Molecular Weight：

388.5 g/mol

Exact Mass：

388.14701584 g/mol

Characteristics

PSA：

86.7 Å²

Computed Properties

Molecular Weight:388.5
XLogP3:3.4
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:388.14701584
Monoisotopic Mass:388.14701584
Topological Polar Surface Area:86.7
Heavy Atom Count:28
Complexity:507
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3-[[4-(4-methylphenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanylmethyl]-6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazole

Basic Attributes
Characteristics
Computed Properties

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