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2-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-4-phenyl-5-thiophen-2-yl-1,2,4-triazole-3-thione

2-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-4-phenyl-5-thiophen-2-yl-1,2,4-triazole-3-thione structure

CAS No:
745796-47-8
Formula:
C22H20N4S2
Chemical Name:
2-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-4-phenyl-5-thiophen-2-yl-1,2,4-triazole-3-thione
Synonyms:
ZINC2645496;AKOS034336224;MCULE-6175954390;Z44089800;4-phenyl-1-[(1,2,3,4-tetrahydroisoquinolin-2-yl)methyl]-3-(thiophen-2-yl)-4,5-dihydro-1H-1,2,4-triazole-5-thione;745796-47-8

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2-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-4-phenyl-5-thiophen-2-yl-1,2,4-triazole-3-thione Basic Attributes

Molecular Weight：

404.6 g/mol

Exact Mass：

404.11293900 g/mol

Characteristics

PSA：

82.4 Å²

Computed Properties

Molecular Weight:404.6
XLogP3:5.1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:404.11293900
Monoisotopic Mass:404.11293900
Topological Polar Surface Area:82.4
Heavy Atom Count:28
Complexity:603
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-4-phenyl-5-thiophen-2-yl-1,2,4-triazole-3-thione

Basic Attributes
Characteristics
Computed Properties

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