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[3-(1H-benzimidazol-2-yl)-3-cyano-2-hydroxyprop-2-enyl] 3,4,5-trichloropyridine-2-carboxylate

[3-(1H-benzimidazol-2-yl)-3-cyano-2-hydroxyprop-2-enyl] 3,4,5-trichloropyridine-2-carboxylate structure

CAS No:
730974-34-2
Formula:
C17H9Cl3N4O3
Chemical Name:
[3-(1H-benzimidazol-2-yl)-3-cyano-2-hydroxyprop-2-enyl] 3,4,5-trichloropyridine-2-carboxylate
Synonyms:
ZINC3281964;Z16550832;3-cyano-3-(2,3-dihydro-1H-1,3-benzodiazol-2-ylidene)-2-oxopropyl 3,4,5-trichloropyridine-2-carboxylate;730974-34-2

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[3-(1H-benzimidazol-2-yl)-3-cyano-2-hydroxyprop-2-enyl] 3,4,5-trichloropyridine-2-carboxylate Basic Attributes

Molecular Weight：

423.6 g/mol

Exact Mass：

421.974023 g/mol

Characteristics

PSA：

112 Å²

Computed Properties

Molecular Weight:423.6
XLogP3:3.6
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:5
Exact Mass:421.974023
Monoisotopic Mass:421.974023
Topological Polar Surface Area:112
Heavy Atom Count:27
Complexity:653
Undefined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of [3-(1H-benzimidazol-2-yl)-3-cyano-2-hydroxyprop-2-enyl] 3,4,5-trichloropyridine-2-carboxylate

Basic Attributes
Characteristics
Computed Properties
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