Tert-butyl 1-(1,4-dichloroisoquinolin-7-yl)sulfonylpiperidine-2-carboxylate

HCID 73300599
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Basic information

Standard SMILES
CC(C)(C)OC(=O)C1CCCCN1S(=O)(=O)c1ccc2c(Cl)cnc(Cl)c2c1
InChIKey
VNLZBZBMFYNBFI-UHFFFAOYSA-N
Molecular formula
C19H22Cl2N2O4S
Average molar mass
445.4 g/mol

Names & identifiers

Preferred name
Tert-butyl 1-(1,4-dichloroisoquinolin-7-yl)sulfonylpiperidine-2-carboxylate
IUPAC
tert-butyl 1-(1,4-dichloroisoquinolin-7-yl)sulfonylpiperidine-2-carboxylate

Database identifiers

PubChem CID
73300599

Properties

Computed structural properties

XLogP
4.6
Topological polar surface area
85 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
6
Rotatable bonds
5
Heavy atoms
28

Related reactions

1 records
New reaction record

Compound notes

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