[2-[2,5-dimethyl-1-(3-methylbutyl)pyrrol-3-yl]-2-oxoethyl] 2-[3-(trifluoromethyl)anilino]benzoate
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![[2-[2,5-dimethyl-1-(3-methylbutyl)pyrrol-3-yl]-2-oxoethyl] 2-[3-(trifluoromethyl)anilino]benzoate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/fee5e240d199420aa5bcfea417864b5e.png "[2-[2,5-dimethyl-1-(3-methylbutyl)pyrrol-3-yl]-2-oxoethyl] 2-[3-(trifluoromethyl)anilino]benzoate")
[2-[2,5-dimethyl-1-(3-methylbutyl)pyrrol-3-yl]-2-oxoethyl] 2-[3-(trifluoromethyl)anilino]benzoate
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CAS No:
736934-07-9
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Formula:
C27H29F3N2O3
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Chemical Name:
[2-[2,5-dimethyl-1-(3-methylbutyl)pyrrol-3-yl]-2-oxoethyl] 2-[3-(trifluoromethyl)anilino]benzoate
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Synonyms:
ZINC3308602;AKOS033646647;MCULE-5442177257;Z18864371;2-[2,5-dimethyl-1-(3-methylbutyl)-1H-pyrrol-3-yl]-2-oxoethyl 2-{[3-(trifluoromethyl)phenyl]amino}benzoate;736934-07-9
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CAS No:
[2-[2,5-dimethyl-1-(3-methylbutyl)pyrrol-3-yl]-2-oxoethyl] 2-[3-(trifluoromethyl)anilino]benzoate Basic Attributes
486.5 g/mol
486.21302728 g/mol
Computed Properties
Molecular Weight:486.5
XLogP3:7.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:10
Exact Mass:486.21302728
Monoisotopic Mass:486.21302728
Topological Polar Surface Area:60.3
Heavy Atom Count:35
Complexity:714
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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