Adamantane-1-carboxylic acid (6-methanesulfonyl-benzothiazol-2-yl)-amide

HCID 5000635
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Basic information

Standard SMILES
CS(=O)(=O)c1ccc2nc(NC(=O)C34CC5CC(CC(C5)C3)C4)sc2c1
InChIKey
AIROLYFGTUDHSL-UHFFFAOYSA-N
Molecular formula
C19H22N2O3S2
Average molar mass
390.5 g/mol

Names & identifiers

Preferred name
Adamantane-1-carboxylic acid (6-methanesulfonyl-benzothiazol-2-yl)-amide
IUPAC
N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)adamantane-1-carboxamide

Names & synonyms

SCHEMBL963747AIROLYFGTUDHSL-UHFFFAOYSA-NAKOS003859432AB00993093-01Z28180011Adamantane-1-carboxylic acid (6-methanesulfonyl-benzothiazol-2-yl)-amide

Database identifiers

PubChem CID
5000635

Properties

Computed structural properties

XLogP
3.7
Topological polar surface area
113 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
3
Heavy atoms
26

Related reactions

5 records
New reaction record

Linked notes

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