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dimethyl (2S,3aS,8bR)-4-(benzenesulfonyl)-1,2,3a,8b-tetrahydropyrrolo[2,3-b]indole-2,3-dicarboxylate

dimethyl (2S,3aS,8bR)-4-(benzenesulfonyl)-1,2,3a,8b-tetrahydropyrrolo[2,3-b]indole-2,3-dicarboxylate structure

CAS No:
136057-11-9
Formula:
C20H20N2O6S
Chemical Name:
dimethyl (2S,3aS,8bR)-4-(benzenesulfonyl)-1,2,3a,8b-tetrahydropyrrolo[2,3-b]indole-2,3-dicarboxylate
Synonyms:
NSC676577;136057-11-9;CHEMBL1979215;DTXSID50327673;ZINC4026693;STL525987;AKOS030490425;MCULE-3354494438;NSC-676577;NCI60_027117;1,2,3,3abeta,8,8abeta-Hexahydro-8-(phenylsulfonyl)pyrrolo[2,3-b]indole-1,2alpha-dicarboxylic acid dimethyl ester;dimethyl (2S,3aR,8aS)-8-(phenylsulfonyl)-3,3a,8,8a-tetrahydropyrrolo[2,3-b]indole-1,2(2H)-dicarboxylate

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dimethyl (2S,3aS,8bR)-4-(benzenesulfonyl)-1,2,3a,8b-tetrahydropyrrolo[2,3-b]indole-2,3-dicarboxylate Basic Attributes

Molecular Weight：

416.4 g/mol

Exact Mass：

416.10420754 g/mol

NSC Number：

676577

DSSTox ID：

DTXSID50327673

Characteristics

PSA：

102 Å²

Computed Properties

Molecular Weight:416.4
XLogP3:2.6
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:5
Exact Mass:416.10420754
Monoisotopic Mass:416.10420754
Topological Polar Surface Area:102
Heavy Atom Count:29
Complexity:745
Defined Atom Stereocenter Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of dimethyl (2S,3aS,8bR)-4-(benzenesulfonyl)-1,2,3a,8b-tetrahydropyrrolo[2,3-b]indole-2,3-dicarboxylate

Basic Attributes
Characteristics
Computed Properties
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