3-[4-[(Z)-3-amino-2-cyano-3-oxoprop-1-enyl]-3-(3-chlorophenyl)pyrazol-1-yl]propanoic acid
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![3-[4-[(Z)-3-amino-2-cyano-3-oxoprop-1-enyl]-3-(3-chlorophenyl)pyrazol-1-yl]propanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/7e9085ce63b944f388b6f3349c66681b.png "3-[4-[(Z)-3-amino-2-cyano-3-oxoprop-1-enyl]-3-(3-chlorophenyl)pyrazol-1-yl]propanoic acid")
3-[4-[(Z)-3-amino-2-cyano-3-oxoprop-1-enyl]-3-(3-chlorophenyl)pyrazol-1-yl]propanoic acid
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CAS No:
882224-30-8
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Formula:
C16H13ClN4O3
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Chemical Name:
3-[4-[(Z)-3-amino-2-cyano-3-oxoprop-1-enyl]-3-(3-chlorophenyl)pyrazol-1-yl]propanoic acid
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Synonyms:
882224-30-8;3-{4-[(1Z)-2-carbamoyl-2-cyanoeth-1-en-1-yl]-3-(3-chlorophenyl)-1H-pyrazol-1-yl}propanoic acid;ZINC3273802;AKOS024603746;SR-01000010838;SR-01000010838-1;F1218-0712;(Z)-3-(4-(3-amino-2-cyano-3-oxoprop-1-en-1-yl)-3-(3-chlorophenyl)-1H-pyrazol-1-yl)propanoic acid
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CAS No:
3-[4-[(Z)-3-amino-2-cyano-3-oxoprop-1-enyl]-3-(3-chlorophenyl)pyrazol-1-yl]propanoic acid Basic Attributes
344.75 g/mol
344.0676180 g/mol
Computed Properties
Molecular Weight:344.75
XLogP3:1.2
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:6
Exact Mass:344.0676180
Monoisotopic Mass:344.0676180
Topological Polar Surface Area:122
Heavy Atom Count:24
Complexity:571
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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