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2-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-hydroxybut-2-enenitrile
2-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-hydroxybut-2-enenitrile
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![2-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-hydroxybut-2-enenitrile structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/75133100ed7849b6b6abf8467e99de66.png "2-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-hydroxybut-2-enenitrile")
2-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-hydroxybut-2-enenitrile
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CAS No:
721417-91-0
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Formula:
C22H18ClN3OS
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Chemical Name:
2-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-hydroxybut-2-enenitrile
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Synonyms:
Z55524099;2-[4-(4-chlorophenyl)-2,3-dihydro-1,3-thiazol-2-ylidene]-3-oxo-4-(1,2,3,4-tetrahydroisoquinolin-2-yl)butanenitrile;721417-91-0
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CAS No:
2-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-hydroxybut-2-enenitrile Basic Attributes
407.9 g/mol
407.0859111 g/mol
Computed Properties
Molecular Weight:407.9
XLogP3:4.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:407.0859111
Monoisotopic Mass:407.0859111
Topological Polar Surface Area:88.4
Heavy Atom Count:28
Complexity:625
Undefined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Guide of 2-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-hydroxybut-2-enenitrile
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