4-[2-(4-Chloro-2,5-dimethoxy-phenylsulfamoyl)-thieno[3,2-c]pyridin-4-yl]-piperazine-1-carboxylic acid tert-butyl ester

HCID 67157136
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Basic information

Standard SMILES
COc1cc(NS(=O)(=O)c2cc3c(N4CCN(C(=O)OC(C)(C)C)CC4)nccc3s2)c(OC)cc1Cl
InChIKey
WGYKCVMQILEKCE-UHFFFAOYSA-N
Molecular formula
C24H29ClN4O6S2
Average molar mass
569.1 g/mol

Names & identifiers

Preferred name
4-[2-(4-Chloro-2,5-dimethoxy-phenylsulfamoyl)-thieno[3,2-c]pyridin-4-yl]-piperazine-1-carboxylic acid tert-butyl ester
IUPAC
tert-butyl 4-[2-[(4-chloro-2,5-dimethoxyphenyl)sulfamoyl]thieno[3,2-c]pyridin-4-yl]piperazine-1-carboxylate

Names & synonyms

SCHEMBL1775413WGYKCVMQILEKCE-UHFFFAOYSA-N4-[2-(4-chloro-2,5-dimethoxy-phenylsulfamoyl)-thieno[3,2-c]pyridin-4-yl]-piperazine-1-carboxylic acid tert-butyl ester

Database identifiers

PubChem CID
67157136

Properties

Computed structural properties

XLogP
4.4
Topological polar surface area
147 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
10
Rotatable bonds
8
Heavy atoms
37

Related reactions

1 records
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Compound notes

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