Tert-butyl 3-iodo-5-(2-methylsulfonylbenzenesulfonylamino)indazole-1-carboxylate

HCID 22567134

Basic information

Standard SMILES
CC(C)(C)OC(=O)n1nc(I)c2cc(NS(=O)(=O)c3ccccc3S(C)(=O)=O)ccc21
InChIKey
HVHBPPHCACXALZ-UHFFFAOYSA-N
Molecular formula
C19H20IN3O6S2
Average molar mass
577.4 g/mol

Names & identifiers

Preferred name
Tert-butyl 3-iodo-5-(2-methylsulfonylbenzenesulfonylamino)indazole-1-carboxylate
IUPAC
tert-butyl 3-iodo-5-[(2-methylsulfonylphenyl)sulfonylamino]indazole-1-carboxylate

Names & synonyms

SCHEMBL4008201HVHBPPHCACXALZ-UHFFFAOYSA-Ntert-butyl 3-iodo-5-(2-methylsulfonylbenzenesulfonylamino)-indazole-1-carboxylatetert-butyl 3-iodo-5-(2-methylsulfonylbenzenesulfonylamino)indazole-1-carboxylate

Database identifiers

PubChem CID
22567134

Properties

Computed structural properties

XLogP
3.3
Topological polar surface area
141 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
8
Rotatable bonds
6
Heavy atoms
31

Related reactions

29 records

Linked notes

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