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[2-[2-cyanoethyl(methyl)amino]-2-oxoethyl] 4-[[(3-chloro-4-fluorophenyl)sulfonylamino]methyl]benzoate

[2-[2-cyanoethyl(methyl)amino]-2-oxoethyl] 4-[[(3-chloro-4-fluorophenyl)sulfonylamino]methyl]benzoate structure

CAS No:
786727-64-8
Formula:
C20H19ClFN3O5S
Chemical Name:
[2-[2-cyanoethyl(methyl)amino]-2-oxoethyl] 4-[[(3-chloro-4-fluorophenyl)sulfonylamino]methyl]benzoate
Synonyms:
SMR000248058;MLS000393219;MLS003913024;CHEMBL1322813;HMS2565A23;ZINC3374441;AKOS033724808;MCULE-4904948957;Z20001462;[(2-cyanoethyl)(methyl)carbamoyl]methyl 4-[(3-chloro-4-fluorobenzenesulfonamido)methyl]benzoate;786727-64-8

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[2-[2-cyanoethyl(methyl)amino]-2-oxoethyl] 4-[[(3-chloro-4-fluorophenyl)sulfonylamino]methyl]benzoate Basic Attributes

Molecular Weight：

467.9 g/mol

Exact Mass：

467.0717977 g/mol

Characteristics

PSA：

125 Å²

Computed Properties

Molecular Weight:467.9
XLogP3:2.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:10
Exact Mass:467.0717977
Monoisotopic Mass:467.0717977
Topological Polar Surface Area:125
Heavy Atom Count:31
Complexity:773
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of [2-[2-cyanoethyl(methyl)amino]-2-oxoethyl] 4-[[(3-chloro-4-fluorophenyl)sulfonylamino]methyl]benzoate

Basic Attributes
Characteristics
Computed Properties
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