1-[2,5-dimethyl-1-(thiophen-2-ylmethyl)pyrrol-3-yl]-2-[[5-[(2-methylphenoxy)methyl]-1H-1,2,4-triazol-3-yl]sulfanyl]ethanone
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1-[2,5-dimethyl-1-(thiophen-2-ylmethyl)pyrrol-3-yl]-2-[[5-[(2-methylphenoxy)methyl]-1H-1,2,4-triazol-3-yl]sulfanyl]ethanone
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CAS No:
743445-82-1
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Formula:
C23H24N4O2S2
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Chemical Name:
1-[2,5-dimethyl-1-(thiophen-2-ylmethyl)pyrrol-3-yl]-2-[[5-[(2-methylphenoxy)methyl]-1H-1,2,4-triazol-3-yl]sulfanyl]ethanone
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Synonyms:
ZINC2655371;AKOS033927542;MCULE-7759831907;Z24896861;1-{2,5-dimethyl-1-[(thiophen-2-yl)methyl]-1H-pyrrol-3-yl}-2-({5-[(2-methylphenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)ethan-1-one;743445-82-1
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CAS No:
1-[2,5-dimethyl-1-(thiophen-2-ylmethyl)pyrrol-3-yl]-2-[[5-[(2-methylphenoxy)methyl]-1H-1,2,4-triazol-3-yl]sulfanyl]ethanone Basic Attributes
452.6 g/mol
452.13406837 g/mol
Computed Properties
Molecular Weight:452.6
XLogP3:5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:9
Exact Mass:452.13406837
Monoisotopic Mass:452.13406837
Topological Polar Surface Area:126
Heavy Atom Count:31
Complexity:598
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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