 Home > Encyclopedia > [2-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2,5-dimethylpyrrol-3-yl]-2-oxoethyl] 4-[(2-cyanoacetyl)amino]benzoate

[2-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2,5-dimethylpyrrol-3-yl]-2-oxoethyl] 4-[(2-cyanoacetyl)amino]benzoate

[2-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2,5-dimethylpyrrol-3-yl]-2-oxoethyl] 4-[(2-cyanoacetyl)amino]benzoate structure

CAS No:
757215-80-8
Formula:
C26H23N3O6
Chemical Name:
[2-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2,5-dimethylpyrrol-3-yl]-2-oxoethyl] 4-[(2-cyanoacetyl)amino]benzoate
Synonyms:
HMS1718G12;ZINC2618898;AKOS000858948;MCULE-5757302390;Z18636438;2-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2,5-dimethyl-1H-pyrrol-3-yl]-2-oxoethyl 4-(2-cyanoacetamido)benzoate;757215-80-8

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[2-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2,5-dimethylpyrrol-3-yl]-2-oxoethyl] 4-[(2-cyanoacetyl)amino]benzoate Basic Attributes

Molecular Weight：

473.5 g/mol

Exact Mass：

473.15868546 g/mol

Characteristics

PSA：

120 Å²

Computed Properties

Molecular Weight:473.5
XLogP3:3.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:8
Exact Mass:473.15868546
Monoisotopic Mass:473.15868546
Topological Polar Surface Area:120
Heavy Atom Count:35
Complexity:832
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of [2-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2,5-dimethylpyrrol-3-yl]-2-oxoethyl] 4-[(2-cyanoacetyl)amino]benzoate

Basic Attributes
Characteristics
Computed Properties
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