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

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

CAS No:
745021-91-4
Formula:
C22H16N4O3
Chemical Name:
[3-(1H-benzimidazol-2-yl)-3-cyano-2-hydroxyprop-2-enyl] 2-methylquinoline-4-carboxylate
Synonyms:
ZINC2637333;Z16536915;3-cyano-3-(2,3-dihydro-1H-1,3-benzodiazol-2-ylidene)-2-oxopropyl 2-methylquinoline-4-carboxylate;745021-91-4

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

Molecular Weight：

384.4 g/mol

Exact Mass：

384.12224039 g/mol

Characteristics

PSA：

112 Å²

Computed Properties

Molecular Weight:384.4
XLogP3:3.1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:5
Exact Mass:384.12224039
Monoisotopic Mass:384.12224039
Topological Polar Surface Area:112
Heavy Atom Count:29
Complexity:699
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] 2-methylquinoline-4-carboxylate

Basic Attributes
Characteristics
Computed Properties
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