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[3-(1H-benzimidazol-2-yl)-3-cyano-2-hydroxyprop-2-enyl] 9H-xanthene-9-carboxylate

[3-(1H-benzimidazol-2-yl)-3-cyano-2-hydroxyprop-2-enyl] 9H-xanthene-9-carboxylate structure

CAS No:
380445-53-4
Formula:
C25H17N3O4
Chemical Name:
[3-(1H-benzimidazol-2-yl)-3-cyano-2-hydroxyprop-2-enyl] 9H-xanthene-9-carboxylate
Synonyms:
ZINC6017346;Z18367771;3-cyano-3-(2,3-dihydro-1H-1,3-benzodiazol-2-ylidene)-2-oxopropyl 9H-xanthene-9-carboxylate;380445-53-4

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[3-(1H-benzimidazol-2-yl)-3-cyano-2-hydroxyprop-2-enyl] 9H-xanthene-9-carboxylate Basic Attributes

Molecular Weight：

423.4 g/mol

Exact Mass：

423.12190603 g/mol

Characteristics

PSA：

108 Å²

Computed Properties

Molecular Weight:423.4
XLogP3:3.7
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:5
Exact Mass:423.12190603
Monoisotopic Mass:423.12190603
Topological Polar Surface Area:108
Heavy Atom Count:32
Complexity:767
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] 9H-xanthene-9-carboxylate

Basic Attributes
Characteristics
Computed Properties
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