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

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

CAS No:
763087-08-7
Formula:
C25H26N4S2
Chemical Name:
2-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-4-(2-phenylethyl)-5-(thiophen-2-ylmethyl)-1,2,4-triazole-3-thione
Synonyms:
ZINC2624112;AKOS008003032;MCULE-2686427798;Z44089933;4-(2-phenylethyl)-1-[(1,2,3,4-tetrahydroisoquinolin-2-yl)methyl]-3-[(thiophen-2-yl)methyl]-4,5-dihydro-1H-1,2,4-triazole-5-thione;763087-08-7

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

Molecular Weight：

446.6 g/mol

Exact Mass：

446.15988919 g/mol

Characteristics

PSA：

82.4 Å²

Computed Properties

Molecular Weight:446.6
XLogP3:5.1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:7
Exact Mass:446.15988919
Monoisotopic Mass:446.15988919
Topological Polar Surface Area:82.4
Heavy Atom Count:31
Complexity:647
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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

Basic Attributes
Characteristics
Computed Properties

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