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1-(2,4-dimethoxyphenyl)-2-[[4-(4-fluorophenyl)-5-(pyrrolidin-1-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanone

1-(2,4-dimethoxyphenyl)-2-[[4-(4-fluorophenyl)-5-(pyrrolidin-1-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanone structure

CAS No:
794582-88-0
Formula:
C23H25FN4O3S
Chemical Name:
1-(2,4-dimethoxyphenyl)-2-[[4-(4-fluorophenyl)-5-(pyrrolidin-1-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanone
Synonyms:
SMR000249505;MLS000334747;MLS003912163;CHEMBL1432958;HMS2595N23;HMS3380O15;ZINC3327542;AKOS033576000;MCULE-4734406943;Z17433668;1-(2,4-dimethoxyphenyl)-2-{[4-(4-fluorophenyl)-5-[(pyrrolidin-1-yl)methyl]-4H-1,2,4-triazol-3-yl]sulfanyl}ethan-1-one;794582-88-0

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1-(2,4-dimethoxyphenyl)-2-[[4-(4-fluorophenyl)-5-(pyrrolidin-1-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanone Basic Attributes

Molecular Weight：

456.5 g/mol

Exact Mass：

456.16314001 g/mol

Characteristics

PSA：

94.8 Å²

Computed Properties

Molecular Weight:456.5
XLogP3:3.7
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:9
Exact Mass:456.16314001
Monoisotopic Mass:456.16314001
Topological Polar Surface Area:94.8
Heavy Atom Count:32
Complexity:604
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-(2,4-dimethoxyphenyl)-2-[[4-(4-fluorophenyl)-5-(pyrrolidin-1-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanone

Basic Attributes
Characteristics
Computed Properties

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