2-(1H-benzimidazol-2-yl)-4-[[5-(4-fluorophenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-3-hydroxybut-2-enenitrile
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![2-(1H-benzimidazol-2-yl)-4-[[5-(4-fluorophenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-3-hydroxybut-2-enenitrile structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/f04426a11be24a1ba8cce98600dda477.png "2-(1H-benzimidazol-2-yl)-4-[[5-(4-fluorophenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-3-hydroxybut-2-enenitrile")
2-(1H-benzimidazol-2-yl)-4-[[5-(4-fluorophenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-3-hydroxybut-2-enenitrile
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CAS No:
756844-92-5
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Formula:
C25H17FN6OS
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Chemical Name:
2-(1H-benzimidazol-2-yl)-4-[[5-(4-fluorophenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-3-hydroxybut-2-enenitrile
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Synonyms:
ZINC2663688;Z24157952;2-(2,3-dihydro-1H-1,3-benzodiazol-2-ylidene)-4-{[5-(4-fluorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-3-oxobutanenitrile;756844-92-5
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CAS No:
2-(1H-benzimidazol-2-yl)-4-[[5-(4-fluorophenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-3-hydroxybut-2-enenitrile Basic Attributes
468.5 g/mol
468.11685852 g/mol
Computed Properties
Molecular Weight:468.5
XLogP3:4.4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:6
Exact Mass:468.11685852
Monoisotopic Mass:468.11685852
Topological Polar Surface Area:129
Heavy Atom Count:34
Complexity:775
Undefined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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