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2-[[5-(4-tert-butylphenyl)-4-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-1-phenylethanone

2-[[5-(4-tert-butylphenyl)-4-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-1-phenylethanone structure

CAS No:
499103-33-2
Formula:
C27H27N3O2S
Chemical Name:
2-[[5-(4-tert-butylphenyl)-4-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-1-phenylethanone
Synonyms:
2-{[5-(4-tert-butylphenyl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-phenylethanone;ZINC1801401;STK065534;AKOS002173975;MCULE-6066834711;ST50060504;2-((5-(4-(tert-butyl)phenyl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl)thio)-1-phenylethanone;2-{5-[4-(tert-butyl)phenyl]-4-(4-methoxyphenyl)(1,2,4-triazol-3-ylthio)}-1-phe nylethan-1-one;499103-33-2

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2-[[5-(4-tert-butylphenyl)-4-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-1-phenylethanone Basic Attributes

Molecular Weight：

457.6 g/mol

Exact Mass：

457.18239829 g/mol

Characteristics

PSA：

82.3 Å²

Computed Properties

Molecular Weight:457.6
XLogP3:6.6
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:8
Exact Mass:457.18239829
Monoisotopic Mass:457.18239829
Topological Polar Surface Area:82.3
Heavy Atom Count:33
Complexity:617
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-[[5-(4-tert-butylphenyl)-4-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-1-phenylethanone

Basic Attributes
Characteristics
Computed Properties

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