[2-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)amino]-2-oxoethyl] 3-chloro-1-benzothiophene-2-carboxylate
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![[2-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)amino]-2-oxoethyl] 3-chloro-1-benzothiophene-2-carboxylate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/5323a90467354e368c969246f7eedff9.png "[2-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)amino]-2-oxoethyl] 3-chloro-1-benzothiophene-2-carboxylate")
[2-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)amino]-2-oxoethyl] 3-chloro-1-benzothiophene-2-carboxylate
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CAS No:
743443-42-7
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Formula:
C22H18ClN3O4S
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Chemical Name:
[2-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)amino]-2-oxoethyl] 3-chloro-1-benzothiophene-2-carboxylate
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Synonyms:
ZINC2649993;AKOS002485840;MCULE-8161896393;Z18785314;[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)carbamoyl]methyl 3-chloro-1-benzothiophene-2-carboxylate;743443-42-7
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CAS No:
[2-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)amino]-2-oxoethyl] 3-chloro-1-benzothiophene-2-carboxylate Basic Attributes
455.9 g/mol
455.0706549 g/mol
Computed Properties
Molecular Weight:455.9
XLogP3:4.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:6
Exact Mass:455.0706549
Monoisotopic Mass:455.0706549
Topological Polar Surface Area:107
Heavy Atom Count:31
Complexity:770
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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