1-[2-[[(2-Chloro-6-fluorophenyl)methyl]thio]ethyl]-2-methyl-5-phenyl-1H-pyrrole-3-carboxylic acid
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![1-[2-[[(2-Chloro-6-fluorophenyl)methyl]thio]ethyl]-2-methyl-5-phenyl-1H-pyrrole-3-carboxylic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/01eb564e922d4c398d41a829ebad7b73.png "1-[2-[[(2-Chloro-6-fluorophenyl)methyl]thio]ethyl]-2-methyl-5-phenyl-1H-pyrrole-3-carboxylic acid")
1-[2-[[(2-Chloro-6-fluorophenyl)methyl]thio]ethyl]-2-methyl-5-phenyl-1H-pyrrole-3-carboxylic acid
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CAS No:
306936-24-3
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Formula:
C21H19ClFNO2S
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Chemical Name:
1-[2-[[(2-Chloro-6-fluorophenyl)methyl]thio]ethyl]-2-methyl-5-phenyl-1H-pyrrole-3-carboxylic acid
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Synonyms:
1H-Pyrrole-3-carboxylic acid,1-[2-[[(2-chloro-6-fluorophenyl)methyl]thio]ethyl]-2-methyl-5-phenyl-;1-[2-[[(2-Chloro-6-fluorophenyl)methyl]thio]ethyl]-2-methyl-5-phenyl-1H-pyrrole-3-carboxylic acid
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CAS No:
1-[2-[[(2-Chloro-6-fluorophenyl)methyl]thio]ethyl]-2-methyl-5-phenyl-1H-pyrrole-3-carboxylic acid Basic Attributes
403.9
403.0809059
DTXSID80381864
Computed Properties
Molecular Weight:403.9
XLogP3:5.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:7
Exact Mass:403.0809059
Monoisotopic Mass:403.0809059
Topological Polar Surface Area:67.5
Heavy Atom Count:27
Complexity:491
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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1-[2-[[(2-Chloro-6-fluorophenyl)methyl]thio]ethyl]-2-methyl-5-phenyl-1H-pyrrole-3-carboxylic acid
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