(4E)-4-(4-methylphenyl)-4-[5-(4-methylphenyl)-2-oxo-1H-pyrrol-3-ylidene]butanoic acid
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![(4E)-4-(4-methylphenyl)-4-[5-(4-methylphenyl)-2-oxo-1H-pyrrol-3-ylidene]butanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/c9946148802344c191ce50617d607e10.png "(4E)-4-(4-methylphenyl)-4-[5-(4-methylphenyl)-2-oxo-1H-pyrrol-3-ylidene]butanoic acid")
(4E)-4-(4-methylphenyl)-4-[5-(4-methylphenyl)-2-oxo-1H-pyrrol-3-ylidene]butanoic acid
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CAS No:
1164466-01-6
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Formula:
C22H21NO3
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Chemical Name:
(4E)-4-(4-methylphenyl)-4-[5-(4-methylphenyl)-2-oxo-1H-pyrrol-3-ylidene]butanoic acid
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Synonyms:
SMR000144971;MLS000550843;CHEMBL1414092;HMS2446N14;ZINC2250597;STL304729;AKOS022129601;4-[2-Oxo-5-p-tolyl-1,2-dihydro-pyrrol-(3E)-ylidene]-4-p-tolyl-butyric acid;(4E)-4-(4-methylphenyl)-4-[5-(4-methylphenyl)-2-oxo-1,2-dihydro-3H-pyrrol-3-ylidene]butanoic acid;1164466-01-6
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CAS No:
(4E)-4-(4-methylphenyl)-4-[5-(4-methylphenyl)-2-oxo-1H-pyrrol-3-ylidene]butanoic acid Basic Attributes
347.4 g/mol
347.15214353 g/mol
Computed Properties
Molecular Weight:347.4
XLogP3:4.2
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:5
Exact Mass:347.15214353
Monoisotopic Mass:347.15214353
Topological Polar Surface Area:66.4
Heavy Atom Count:26
Complexity:603
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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