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[3-(1H-benzimidazol-2-yl)-3-cyano-2-hydroxyprop-2-enyl] 4-oxo-4-thiophen-2-ylbutanoate

[3-(1H-benzimidazol-2-yl)-3-cyano-2-hydroxyprop-2-enyl] 4-oxo-4-thiophen-2-ylbutanoate structure

CAS No:
454227-63-5
Formula:
C19H15N3O4S
Chemical Name:
[3-(1H-benzimidazol-2-yl)-3-cyano-2-hydroxyprop-2-enyl] 4-oxo-4-thiophen-2-ylbutanoate
Synonyms:
ZINC3348074;Z19709566;3-cyano-3-(2,3-dihydro-1H-1,3-benzodiazol-2-ylidene)-2-oxopropyl 4-oxo-4-(thiophen-2-yl)butanoate;454227-63-5

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[3-(1H-benzimidazol-2-yl)-3-cyano-2-hydroxyprop-2-enyl] 4-oxo-4-thiophen-2-ylbutanoate Basic Attributes

Molecular Weight：

381.4 g/mol

Exact Mass：

381.07832714 g/mol

Characteristics

PSA：

144 Å²

Computed Properties

Molecular Weight:381.4
XLogP3:2.1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:8
Exact Mass:381.07832714
Monoisotopic Mass:381.07832714
Topological Polar Surface Area:144
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] 4-oxo-4-thiophen-2-ylbutanoate

Basic Attributes
Characteristics
Computed Properties
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