4-[2-(4-acetylpiperazin-1-yl)ethyliminomethyl]-2-(4-nitrophenyl)-5-propyl-1H-pyrazol-3-one
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![4-[2-(4-acetylpiperazin-1-yl)ethyliminomethyl]-2-(4-nitrophenyl)-5-propyl-1H-pyrazol-3-one structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/e9da631e70a64e5b91f57540716d3b81.png "4-[2-(4-acetylpiperazin-1-yl)ethyliminomethyl]-2-(4-nitrophenyl)-5-propyl-1H-pyrazol-3-one")
4-[2-(4-acetylpiperazin-1-yl)ethyliminomethyl]-2-(4-nitrophenyl)-5-propyl-1H-pyrazol-3-one
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CAS No:
371956-84-2
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Formula:
C21H28N6O4
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Chemical Name:
4-[2-(4-acetylpiperazin-1-yl)ethyliminomethyl]-2-(4-nitrophenyl)-5-propyl-1H-pyrazol-3-one
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Synonyms:
AK-968/40329478;STK868285;STK957641;AKOS003792704;AKOS005608854;ZINC100163192;ZINC100163195;ZINC100163470;MCULE-1783186899;SR-01000222148;SR-01000222148-1;(4E)-4-({[2-(4-acetylpiperazin-1-yl)ethyl]amino}methylidene)-2-(4-nitrophenyl)-5-propyl-2,4-dihydro-3H-pyrazol-3-one;(E)-4-(((2-(4-acetylpiperazin-1-yl)ethyl)amino)methylene)-1-(4-nitrophenyl)-3-propyl-1H-pyrazol-5(4H)-one;371956-84-2;4-({[2-(4-acetyl-1-piperazinyl)ethyl]amino}methylene)-2-(4-nitrophenyl)-5-propyl-2,4-dihydro-3H-pyrazol-3-one;4-({[2-(4-acetyl-1-piperazinyl)ethyl]imino}methyl)-2-{4-nitrophenyl}-5-propyl-1,2-dihydro-3H-pyrazol-3-one;4-[(E)-{[2-(4-acetylpiperazin-1-yl)ethyl]imino}methyl]-2-(4-nitrophenyl)-5-propyl-1,2-dihydro-3H-pyrazol-3-one
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CAS No:
4-[2-(4-acetylpiperazin-1-yl)ethyliminomethyl]-2-(4-nitrophenyl)-5-propyl-1H-pyrazol-3-one Basic Attributes
428.5 g/mol
428.21720340 g/mol
Computed Properties
Molecular Weight:428.5
XLogP3:1.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:7
Exact Mass:428.21720340
Monoisotopic Mass:428.21720340
Topological Polar Surface Area:114
Heavy Atom Count:31
Complexity:731
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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