2-(1H-benzimidazol-2-yl)-4-[3-chloro-2-oxo-5-(trifluoromethyl)pyridin-1-yl]-3-hydroxybut-2-enenitrile
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![2-(1H-benzimidazol-2-yl)-4-[3-chloro-2-oxo-5-(trifluoromethyl)pyridin-1-yl]-3-hydroxybut-2-enenitrile structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/de0a4b4fdacb46a0a1d5d6fe3c99ccde.png "2-(1H-benzimidazol-2-yl)-4-[3-chloro-2-oxo-5-(trifluoromethyl)pyridin-1-yl]-3-hydroxybut-2-enenitrile")
2-(1H-benzimidazol-2-yl)-4-[3-chloro-2-oxo-5-(trifluoromethyl)pyridin-1-yl]-3-hydroxybut-2-enenitrile
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CAS No:
744262-34-8
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Formula:
C17H10ClF3N4O2
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Chemical Name:
2-(1H-benzimidazol-2-yl)-4-[3-chloro-2-oxo-5-(trifluoromethyl)pyridin-1-yl]-3-hydroxybut-2-enenitrile
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Synonyms:
ZINC2635966;Z53861467;4-[3-chloro-2-oxo-5-(trifluoromethyl)-1,2-dihydropyridin-1-yl]-2-(2,3-dihydro-1H-1,3-benzodiazol-2-ylidene)-3-oxobutanenitrile;744262-34-8
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CAS No:
2-(1H-benzimidazol-2-yl)-4-[3-chloro-2-oxo-5-(trifluoromethyl)pyridin-1-yl]-3-hydroxybut-2-enenitrile Basic Attributes
394.7 g/mol
394.0444378 g/mol
Computed Properties
Molecular Weight:394.7
XLogP3:2.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:3
Exact Mass:394.0444378
Monoisotopic Mass:394.0444378
Topological Polar Surface Area:93
Heavy Atom Count:27
Complexity:781
Undefined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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