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2-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-5-(4-methoxyphenyl)-4-[3-(trifluoromethyl)phenyl]-1,2,4-triazole-3-thione

2-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-5-(4-methoxyphenyl)-4-[3-(trifluoromethyl)phenyl]-1,2,4-triazole-3-thione structure

CAS No:
745803-13-8
Formula:
C26H23F3N4OS
Chemical Name:
2-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-5-(4-methoxyphenyl)-4-[3-(trifluoromethyl)phenyl]-1,2,4-triazole-3-thione
Synonyms:
ZINC2646550;AKOS034336268;MCULE-8827654508;Z44090063;3-(4-methoxyphenyl)-1-[(1,2,3,4-tetrahydroisoquinolin-2-yl)methyl]-4-[3-(trifluoromethyl)phenyl]-4,5-dihydro-1H-1,2,4-triazole-5-thione;745803-13-8

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2-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-5-(4-methoxyphenyl)-4-[3-(trifluoromethyl)phenyl]-1,2,4-triazole-3-thione Basic Attributes

Molecular Weight：

496.5 g/mol

Exact Mass：

496.15446703 g/mol

Characteristics

PSA：

63.4 Å²

Computed Properties

Molecular Weight:496.5
XLogP3:5.9
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:5
Exact Mass:496.15446703
Monoisotopic Mass:496.15446703
Topological Polar Surface Area:63.4
Heavy Atom Count:35
Complexity:785
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Hot Searches: smz tmp; dipotassium; sodium nitrite formula; formula for nitrous acid; tianeptine sodium; naclo compound

Guide of 2-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-5-(4-methoxyphenyl)-4-[3-(trifluoromethyl)phenyl]-1,2,4-triazole-3-thione

Basic Attributes
Characteristics
Computed Properties

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