[3-(1H-benzimidazol-2-yl)-3-cyano-2-hydroxyprop-2-enyl] 2-(4-bromophenyl)acetate
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[3-(1H-benzimidazol-2-yl)-3-cyano-2-hydroxyprop-2-enyl] 2-(4-bromophenyl)acetate
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CAS No:
491625-83-3
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Formula:
C19H14BrN3O3
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Chemical Name:
[3-(1H-benzimidazol-2-yl)-3-cyano-2-hydroxyprop-2-enyl] 2-(4-bromophenyl)acetate
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Synonyms:
ZINC3274202;Z18830484;3-cyano-3-(2,3-dihydro-1H-1,3-benzodiazol-2-ylidene)-2-oxopropyl 2-(4-bromophenyl)acetate;491625-83-3
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CAS No:
[3-(1H-benzimidazol-2-yl)-3-cyano-2-hydroxyprop-2-enyl] 2-(4-bromophenyl)acetate Basic Attributes
412.2 g/mol
411.02185 g/mol
Computed Properties
Molecular Weight:412.2
XLogP3:3.1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:6
Exact Mass:411.02185
Monoisotopic Mass:411.02185
Topological Polar Surface Area:99
Heavy Atom Count:26
Complexity:592
Undefined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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