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3-(5-Pyrimidinylamino)benzenesulfonamide

HCID 101787707
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

Standard SMILES
NS(=O)(=O)c1cccc(Nc2cncnc2)c1
InChIKey
BDRCHJKKWCTCJY-UHFFFAOYSA-N
Molecular formula
C10H10N4O2S
Average molar mass
250.28 g/mol

Names & identifiers

Preferred name
3-(5-Pyrimidinylamino)benzenesulfonamide
IUPAC
3-(pyrimidin-5-ylamino)benzenesulfonamide

Names & synonyms

3-(5-pyrimidinylamino)benzenesulfonamide

Database identifiers

PubChem CID
101787707
Nikkaji
J2.937.828B

Properties

Computed structural properties

XLogP
0.3
Topological polar surface area
106 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
6
Rotatable bonds
3
Heavy atoms
17
Formal charge
0
Complexity
335

Related reactions

1 records
New reaction record
HRID 451 reaction equation
HRID 451As product750 AstraZeneca ELN dataset

Compound notes

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