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N-(6-chloro-1,2,3,4-tetrahydroquinolin-3-yl)benzenesulfonamide

HCID 59778174
NotesReactions

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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
O=S(=O)(NC1CNc2ccc(Cl)cc2C1)c1ccccc1
InChIKey
JRODWQXZKJLLDX-UHFFFAOYSA-N
Molecular formula
C15H15ClN2O2S
Average molar mass
322.8 g/mol

Names & identifiers

Preferred name
N-(6-chloro-1,2,3,4-tetrahydroquinolin-3-yl)benzenesulfonamide
IUPAC
N-(6-chloro-1,2,3,4-tetrahydroquinolin-3-yl)benzenesulfonamide

Names & synonyms

SCHEMBL651549JRODWQXZKJLLDX-UHFFFAOYSA-NN-(6-chloro-1,2,3,4-tetrahydroquinolin-3-yl)benzenesulfonamide

Database identifiers

PubChem CID
59778174

Properties

Computed structural propertiesFilling in

XLogP
3.3
Topological polar surface area
66.6 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
4
Rotatable bonds
3
Heavy atoms
21
Formal charge
0
Complexity
445

Related reactions

3 records
New reaction record
HRID 157652 reaction equation
HRID 157652As productTraining data from https://doi.org/10.1039/C8SC04228D (9/10)
HRID 1363086 reaction equation
HRID 1363086As productuspto-grants-2011_02
HRID 1643866 reaction equation
HRID 1643866As productuspto-grants-2012_02

Compound notes

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On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes