[2-[1-(3,4-dimethylphenyl)-2,5-dimethylpyrrol-3-yl]-2-oxoethyl] (2S)-2-(furan-2-carbonylamino)-3-methylbutanoate
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![[2-[1-(3,4-dimethylphenyl)-2,5-dimethylpyrrol-3-yl]-2-oxoethyl] (2S)-2-(furan-2-carbonylamino)-3-methylbutanoate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/93fc4bc98e9342aa8f351db6822113c3.png "[2-[1-(3,4-dimethylphenyl)-2,5-dimethylpyrrol-3-yl]-2-oxoethyl] (2S)-2-(furan-2-carbonylamino)-3-methylbutanoate")
[2-[1-(3,4-dimethylphenyl)-2,5-dimethylpyrrol-3-yl]-2-oxoethyl] (2S)-2-(furan-2-carbonylamino)-3-methylbutanoate
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CAS No:
956613-29-9
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Formula:
C26H30N2O5
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Chemical Name:
[2-[1-(3,4-dimethylphenyl)-2,5-dimethylpyrrol-3-yl]-2-oxoethyl] (2S)-2-(furan-2-carbonylamino)-3-methylbutanoate
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Synonyms:
ZINC2645198;AKOS001053713;MCULE-2907863698;Z56981114;2-[1-(3,4-dimethylphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]-2-oxoethyl (2S)-2-[(furan-2-yl)formamido]-3-methylbutanoate;956613-29-9
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CAS No:
[2-[1-(3,4-dimethylphenyl)-2,5-dimethylpyrrol-3-yl]-2-oxoethyl] (2S)-2-(furan-2-carbonylamino)-3-methylbutanoate Basic Attributes
450.5 g/mol
450.21547206 g/mol
Computed Properties
Molecular Weight:450.5
XLogP3:5.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:9
Exact Mass:450.21547206
Monoisotopic Mass:450.21547206
Topological Polar Surface Area:90.5
Heavy Atom Count:33
Complexity:711
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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