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[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxoethyl] 4-cyanobenzoate

[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxoethyl] 4-cyanobenzoate structure

CAS No:
386281-03-4
Formula:
C18H14N2O5
Chemical Name:
[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxoethyl] 4-cyanobenzoate
Synonyms:
Oprea1_071521;ZINC3315549;STL059816;AKOS002475022;MCULE-8591486852;AB00718806-01;Z18373168;{[(2H-1,3-benzodioxol-5-yl)methyl]carbamoyl}methyl 4-cyanobenzoate;2-[(1,3-benzodioxol-5-ylmethyl)amino]-2-oxoethyl 4-cyanobenzoate;386281-03-4

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[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxoethyl] 4-cyanobenzoate Basic Attributes

Molecular Weight：

338.3 g/mol

Exact Mass：

338.09027155 g/mol

Characteristics

PSA：

97.6 Å²

Computed Properties

Molecular Weight:338.3
XLogP3:2.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:6
Exact Mass:338.09027155
Monoisotopic Mass:338.09027155
Topological Polar Surface Area:97.6
Heavy Atom Count:25
Complexity:535
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of [2-(1,3-benzodioxol-5-ylmethylamino)-2-oxoethyl] 4-cyanobenzoate

Basic Attributes
Characteristics
Computed Properties
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