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[2-(3-cyanoanilino)-2-oxoethyl] 3-chloro-6-fluoro-1-benzothiophene-2-carboxylate

[2-(3-cyanoanilino)-2-oxoethyl] 3-chloro-6-fluoro-1-benzothiophene-2-carboxylate structure

CAS No:
402868-12-6
Formula:
C18H10ClFN2O3S
Chemical Name:
[2-(3-cyanoanilino)-2-oxoethyl] 3-chloro-6-fluoro-1-benzothiophene-2-carboxylate
Synonyms:
ZINC3349330;AKOS002485893;MCULE-8793124226;AB00720434-01;Z18813755;[(3-cyanophenyl)carbamoyl]methyl 3-chloro-6-fluoro-1-benzothiophene-2-carboxylate;402868-12-6

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[2-(3-cyanoanilino)-2-oxoethyl] 3-chloro-6-fluoro-1-benzothiophene-2-carboxylate Basic Attributes

Molecular Weight：

388.8 g/mol

Exact Mass：

388.0084692 g/mol

Characteristics

PSA：

107 Å²

Computed Properties

Molecular Weight:388.8
XLogP3:4.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:5
Exact Mass:388.0084692
Monoisotopic Mass:388.0084692
Topological Polar Surface Area:107
Heavy Atom Count:26
Complexity:598
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of [2-(3-cyanoanilino)-2-oxoethyl] 3-chloro-6-fluoro-1-benzothiophene-2-carboxylate

Basic Attributes
Characteristics
Computed Properties
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