3-[4-[(Z)-2-cyano-3-ethoxy-3-oxoprop-1-enyl]-3-(4-phenylphenyl)pyrazol-1-yl]propanoic acid
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![3-[4-[(Z)-2-cyano-3-ethoxy-3-oxoprop-1-enyl]-3-(4-phenylphenyl)pyrazol-1-yl]propanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/58f09af08f654bb6a28d9e226a93affc.png "3-[4-[(Z)-2-cyano-3-ethoxy-3-oxoprop-1-enyl]-3-(4-phenylphenyl)pyrazol-1-yl]propanoic acid")
3-[4-[(Z)-2-cyano-3-ethoxy-3-oxoprop-1-enyl]-3-(4-phenylphenyl)pyrazol-1-yl]propanoic acid
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CAS No:
1001567-41-4
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Formula:
C24H21N3O4
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Chemical Name:
3-[4-[(Z)-2-cyano-3-ethoxy-3-oxoprop-1-enyl]-3-(4-phenylphenyl)pyrazol-1-yl]propanoic acid
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Synonyms:
1001567-41-4;(Z)-3-(3-([1,1'-biphenyl]-4-yl)-4-(2-cyano-3-ethoxy-3-oxoprop-1-en-1-yl)-1H-pyrazol-1-yl)propanoic acid;3-(3-{[1,1'-biphenyl]-4-yl}-4-[(1Z)-2-cyano-3-ethoxy-3-oxoprop-1-en-1-yl]-1H-pyrazol-1-yl)propanoic acid;ZINC6179701;AKOS024603743;3-[4-[(Z)-2-cyano-3-ethoxy-3-oxoprop-1-enyl]-3-(4-phenylphenyl)pyrazol-1-yl]propanoic acid;AB00685766-01;F1218-0667
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CAS No:
3-[4-[(Z)-2-cyano-3-ethoxy-3-oxoprop-1-enyl]-3-(4-phenylphenyl)pyrazol-1-yl]propanoic acid Basic Attributes
415.4 g/mol
415.15320616 g/mol
Computed Properties
Molecular Weight:415.4
XLogP3:3.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:9
Exact Mass:415.15320616
Monoisotopic Mass:415.15320616
Topological Polar Surface Area:105
Heavy Atom Count:31
Complexity:699
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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