 Home > Encyclopedia > 1-[3-[[4-benzyl-5-(4-tert-butylphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-4-methoxyphenyl]ethanone

1-[3-[[4-benzyl-5-(4-tert-butylphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-4-methoxyphenyl]ethanone

1-[3-[[4-benzyl-5-(4-tert-butylphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-4-methoxyphenyl]ethanone structure

CAS No:
721909-09-7
Formula:
C29H31N3O2S
Chemical Name:
1-[3-[[4-benzyl-5-(4-tert-butylphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-4-methoxyphenyl]ethanone
Synonyms:
ZINC3301777;AKOS033300717;MCULE-6901379563;Z13804751;1-[3-({[4-benzyl-5-(4-tert-butylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-4-methoxyphenyl]ethan-1-one;721909-09-7

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1-[3-[[4-benzyl-5-(4-tert-butylphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-4-methoxyphenyl]ethanone Basic Attributes

Molecular Weight：

485.6 g/mol

Exact Mass：

485.21369841 g/mol

Characteristics

PSA：

82.3 Å²

Computed Properties

Molecular Weight:485.6
XLogP3:6.3
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:9
Exact Mass:485.21369841
Monoisotopic Mass:485.21369841
Topological Polar Surface Area:82.3
Heavy Atom Count:35
Complexity:669
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-[3-[[4-benzyl-5-(4-tert-butylphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-4-methoxyphenyl]ethanone

Basic Attributes
Characteristics
Computed Properties

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