Compound C13H13N3O8S3

3-[[(4-sulfamoylphenyl)sulfonylamino]sulfamoyl]benzoic acid

CAS: 62646-44-0

Molecular Formula	`C13H13N3O8S3`
Molecular Weight	435.5 g/mol
LogP	-0.2
Topological Polar Surface Area	215.0 A2
Hydrogen Bond Donors	4
Hydrogen Bond Acceptors	11
Rotatable Bonds	7
Exact Mass	434.98648
Heavy Atoms	27
Complexity	844.0

Chemical Identifiers

CAS Number	62646-44-0
SMILES	`C1=CC(=CC(=C1)S(=O)(=O)NNS(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N)C(=O)O`
InChIKey	`KQGIECCWAJZCSV-UHFFFAOYSA-N`

📖 Product Overview

Compound C13H13N3O8S3 (CAS: 62646-44-0) is a chemical compound with molecular formula C13H13N3O8S3 and molecular weight 435.5 g/mol. Its IUPAC systematic name is 3-[[(4-sulfamoylphenyl)sulfonylamino]sulfamoyl]benzoic acid. LogP -0.2 Topological Polar Surface Area 215.0 A2 Hydrogen Bond Donors 4 Hydrogen Bond Acceptors 11 Rotatable Bonds 7 Exact Mass 434.98648 Heavy Atoms 27 Complexity 844.0 InChI Key: KQGIECCWAJZCSV-UHFFFAOYSA-N. SMILES: C1=CC(=CC(=C1)S(=O)(=O)NNS(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N)C(=O)O.

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