Methyl 2-[(pyridin-3-ylamino)sulfonyl]benzoate

HCID 4354882
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Basic information

Standard SMILES
COC(=O)c1ccccc1S(=O)(=O)Nc1cccnc1
InChIKey
ITAXXEIRIFKXHI-UHFFFAOYSA-N
Molecular formula
C13H12N2O4S
Average molar mass
292.31 g/mol
Monoisotopic mass
292.05177804

Names & identifiers

Preferred name
Methyl 2-[(pyridin-3-ylamino)sulfonyl]benzoate
IUPAC
methyl 2-(pyridin-3-ylsulfamoyl)benzoate

Names & synonyms

SCHEMBL1050952ITAXXEIRIFKXHI-UHFFFAOYSA-NMethyl 2-[(pyridin-3-ylamino)sulfonyl]benzoateAB00010154-01

Database identifiers

PubChem CID
4354882

Properties

Computed structural properties

XLogP
1.2
Topological polar surface area
93.7 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
6
Rotatable bonds
5
Heavy atoms
20

Related reactions

8 records
New reaction record

Compound notes

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