2-(1H-benzimidazol-2-yl)-4-[3-(3-chloro-2-methylphenyl)-4-oxoquinazolin-2-yl]sulfanyl-3-hydroxybut-2-enenitrile
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2-(1H-benzimidazol-2-yl)-4-[3-(3-chloro-2-methylphenyl)-4-oxoquinazolin-2-yl]sulfanyl-3-hydroxybut-2-enenitrile
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CAS No:
491631-64-2
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Formula:
C26H18ClN5O2S
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Chemical Name:
2-(1H-benzimidazol-2-yl)-4-[3-(3-chloro-2-methylphenyl)-4-oxoquinazolin-2-yl]sulfanyl-3-hydroxybut-2-enenitrile
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Synonyms:
ZINC3292368;Z19109745;4-{[3-(3-chloro-2-methylphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}-2-(2,3-dihydro-1H-1,3-benzodiazol-2-ylidene)-3-oxobutanenitrile;491631-64-2
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CAS No:
2-(1H-benzimidazol-2-yl)-4-[3-(3-chloro-2-methylphenyl)-4-oxoquinazolin-2-yl]sulfanyl-3-hydroxybut-2-enenitrile Basic Attributes
500.0 g/mol
499.0869737 g/mol
Computed Properties
Molecular Weight:500.0
XLogP3:5.1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:5
Exact Mass:499.0869737
Monoisotopic Mass:499.0869737
Topological Polar Surface Area:131
Heavy Atom Count:35
Complexity:932
Undefined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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