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

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

CAS No:
454244-47-4
Formula:
C19H13N3O5
Chemical Name:
[3-(1H-benzimidazol-2-yl)-3-cyano-2-hydroxyprop-2-enyl] 1,3-benzodioxole-5-carboxylate
Synonyms:
ZINC2658704;Z18363088;3-cyano-3-(2,3-dihydro-1H-1,3-benzodiazol-2-ylidene)-2-oxopropyl 2H-1,3-benzodioxole-5-carboxylate;454244-47-4

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

Molecular Weight：

363.3 g/mol

Exact Mass：

363.08552052 g/mol

Characteristics

PSA：

118 Å²

Computed Properties

Molecular Weight:363.3
XLogP3:2.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:5
Exact Mass:363.08552052
Monoisotopic Mass:363.08552052
Topological Polar Surface Area:118
Heavy Atom Count:27
Complexity:657
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] 1,3-benzodioxole-5-carboxylate

Basic Attributes
Characteristics
Computed Properties
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