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[2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl] (2S)-2-acetamido-3-(1H-indol-3-yl)propanoate

[2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl] (2S)-2-acetamido-3-(1H-indol-3-yl)propanoate structure

CAS No:
956612-33-2
Formula:
C22H21N3O6
Chemical Name:
[2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl] (2S)-2-acetamido-3-(1H-indol-3-yl)propanoate
Synonyms:
MLS002635710;CHEMBL1734104;HMS3091O09;ZINC2651706;AKOS034826985;MCULE-3377718087;SMR001544544;Z56985616;[(2H-1,3-benzodioxol-5-yl)carbamoyl]methyl (2S)-2-acetamido-3-(1H-indol-3-yl)propanoate;956612-33-2

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[2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl] (2S)-2-acetamido-3-(1H-indol-3-yl)propanoate Basic Attributes

Molecular Weight：

423.4 g/mol

Exact Mass：

423.14303540 g/mol

Characteristics

PSA：

119 Å²

Computed Properties

Molecular Weight:423.4
XLogP3:2.3
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:8
Exact Mass:423.14303540
Monoisotopic Mass:423.14303540
Topological Polar Surface Area:119
Heavy Atom Count:31
Complexity:674
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of [2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl] (2S)-2-acetamido-3-(1H-indol-3-yl)propanoate

Basic Attributes
Characteristics
Computed Properties
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