2-[[5-[(4-chlorophenoxy)methyl]-1H-1,2,4-triazol-3-yl]sulfanyl]-1-(5-chlorothiophen-2-yl)ethanone
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2-[[5-[(4-chlorophenoxy)methyl]-1H-1,2,4-triazol-3-yl]sulfanyl]-1-(5-chlorothiophen-2-yl)ethanone
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CAS No:
785801-79-8
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Formula:
C15H11Cl2N3O2S2
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Chemical Name:
2-[[5-[(4-chlorophenoxy)methyl]-1H-1,2,4-triazol-3-yl]sulfanyl]-1-(5-chlorothiophen-2-yl)ethanone
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Synonyms:
ZINC3322907;AKOS033942399;MCULE-7463194055;Z25467981;2-({5-[(4-chlorophenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-1-(5-chlorothiophen-2-yl)ethan-1-one;785801-79-8
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CAS No:
2-[[5-[(4-chlorophenoxy)methyl]-1H-1,2,4-triazol-3-yl]sulfanyl]-1-(5-chlorothiophen-2-yl)ethanone Basic Attributes
400.3 g/mol
398.9669743 g/mol
Computed Properties
Molecular Weight:400.3
XLogP3:5.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:7
Exact Mass:398.9669743
Monoisotopic Mass:398.9669743
Topological Polar Surface Area:121
Heavy Atom Count:24
Complexity:428
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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