2-Acetyl-7-chloro-8-sulfamyl-1,2,3,4-tetrahydroisoquinoline

HCID 21393800
Substructure searchFind similar structures

Basic information

Standard SMILES
CC(=O)N1CCc2ccc(Cl)c(S(N)(=O)=O)c2C1
InChIKey
PZENLUROLZIUTA-UHFFFAOYSA-N
Molecular formula
C11H13ClN2O3S
Average molar mass
288.75 g/mol

Names & identifiers

Preferred name
2-Acetyl-7-chloro-8-sulfamyl-1,2,3,4-tetrahydroisoquinoline
IUPAC
2-acetyl-7-chloro-3,4-dihydro-1H-isoquinoline-8-sulfonamide

Names & synonyms

SCHEMBL11737584PZENLUROLZIUTA-UHFFFAOYSA-N2-acetyl-7-chloro-8-sulfamyl-1,2,3,4-tetrahydroisoquinoline

Database identifiers

PubChem CID
21393800

Properties

Computed structural properties

XLogP
0.4
Topological polar surface area
88.9 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
1
Heavy atoms
18

Related reactions

5 records
New reaction record

Linked notes

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