2-[4-[3-(tert-butylamino)-2-hydroxypropoxy]anilino]-5-chlorocyclohepta-2,4,6-trien-1-one
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![2-[4-[3-(tert-butylamino)-2-hydroxypropoxy]anilino]-5-chlorocyclohepta-2,4,6-trien-1-one structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/b775b1cb9288424c8c830184ac8303f7.png "2-[4-[3-(tert-butylamino)-2-hydroxypropoxy]anilino]-5-chlorocyclohepta-2,4,6-trien-1-one")
2-[4-[3-(tert-butylamino)-2-hydroxypropoxy]anilino]-5-chlorocyclohepta-2,4,6-trien-1-one
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CAS No:
38767-88-3
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Formula:
C20H25ClN2O3
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Chemical Name:
2-[4-[3-(tert-butylamino)-2-hydroxypropoxy]anilino]-5-chlorocyclohepta-2,4,6-trien-1-one
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Synonyms:
38767-88-3;BRN 2888412;2,4,6-Cycloheptatrien-1-one, 2-(4-(3-(tert-butylamino)-2-hydroxypropoxy)anilino)-5-chloro-;2-(4-(3-(tert-Butylamino)-2-hydroxypropoxy)anilino)-5-chloro-2,4,6-cycloheptatrien-1-one;2,4,6-Cycloheptatrien-1-one, 5-chloro-2-((4-(3-((1,1-dimethylethyl)amino)-2-hydroxypropoxy)phenyl)amino)-;DTXSID50959574;5-Chloro-2-[[4-[3-[(1,1-dimethylethyl)amino]-2-hydroxypropoxy]phenyl]amino]-2,4,6-cycloheptatrien-1-one;7-({4-[3-(tert-Butylamino)-2-hydroxypropoxy]phenyl}imino)-4-chlorocyclohepta-1,3,5-trien-1-ol
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CAS No:
2-[4-[3-(tert-butylamino)-2-hydroxypropoxy]anilino]-5-chlorocyclohepta-2,4,6-trien-1-one Basic Attributes
376.9 g/mol
376.1553704 g/mol
Computed Properties
Molecular Weight:376.9
XLogP3:3.6
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:8
Exact Mass:376.1553704
Monoisotopic Mass:376.1553704
Topological Polar Surface Area:70.6
Heavy Atom Count:26
Complexity:570
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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