[2-[2-(cyclohexen-1-yl)ethylamino]-2-oxoethyl] 1-benzyl-5-chloro-3-methylpyrazole-4-carboxylate
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![[2-[2-(cyclohexen-1-yl)ethylamino]-2-oxoethyl] 1-benzyl-5-chloro-3-methylpyrazole-4-carboxylate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/47fcf55956ec43c3a2d4cfba1f34ef4a.png "[2-[2-(cyclohexen-1-yl)ethylamino]-2-oxoethyl] 1-benzyl-5-chloro-3-methylpyrazole-4-carboxylate")
[2-[2-(cyclohexen-1-yl)ethylamino]-2-oxoethyl] 1-benzyl-5-chloro-3-methylpyrazole-4-carboxylate
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CAS No:
956513-96-5
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Formula:
C22H26ClN3O3
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Chemical Name:
[2-[2-(cyclohexen-1-yl)ethylamino]-2-oxoethyl] 1-benzyl-5-chloro-3-methylpyrazole-4-carboxylate
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Synonyms:
ZINC3379927;AKOS033941830;MCULE-5886852625;Z25456928;{[2-(cyclohex-1-en-1-yl)ethyl]carbamoyl}methyl 1-benzyl-5-chloro-3-methyl-1H-pyrazole-4-carboxylate;956513-96-5
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CAS No:
[2-[2-(cyclohexen-1-yl)ethylamino]-2-oxoethyl] 1-benzyl-5-chloro-3-methylpyrazole-4-carboxylate Basic Attributes
415.9 g/mol
415.1662694 g/mol
Computed Properties
Molecular Weight:415.9
XLogP3:4.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:9
Exact Mass:415.1662694
Monoisotopic Mass:415.1662694
Topological Polar Surface Area:73.2
Heavy Atom Count:29
Complexity:592
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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