3-(1H-indazol-3-yl)benzenesulfonamide

C13H11N3O2S — CID 53389592

IUPAC3-(1H-indazol-3-yl)benzenesulfonamide
SMILESNS(=O)(=O)c1cccc(-c2n[nH]c3ccccc23)c1
InChIInChI=1S/C13H11N3O2S/c14-19(17,18)10-5-3-4-9(8-10)13-11-6-1-2-7-12(11)15-16-13/h1-8H,(H,15,16)(H2,14,17,18)
InChIKeyZHDHTEOEZSHAMZ-UHFFFAOYSA-N
MW273.32 g/mol
LogP1.88
Rot. Bonds2

About 3-(1H-indazol-3-yl)benzenesulfonamide

3-(1H-indazol-3-yl)benzenesulfonamide (PubChem CID 53389592) has the molecular formula C13H11N3O2S and a molecular weight of 273.32 g/mol. Its IUPAC name is 3-(1H-indazol-3-yl)benzenesulfonamide.

Molecular Properties

Compound Name3-(1H-indazol-3-yl)benzenesulfonamide
PubChem CID53389592
Molecular FormulaC13H11N3O2S
Molecular Weight273.32 g/mol
Exact Mass273.06
IUPAC Name3-(1H-indazol-3-yl)benzenesulfonamide
SMILESNS(=O)(=O)c1cccc(-c2n[nH]c3ccccc23)c1
InChIInChI=1S/C13H11N3O2S/c14-19(17,18)10-5-3-4-9(8-10)13-11-6-1-2-7-12(11)15-16-13/h1-8H,(H,15,16)(H2,14,17,18)
InChIKeyZHDHTEOEZSHAMZ-UHFFFAOYSA-N
XLogP1.88
TPSA88.84 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.32
LogP ≤ 51.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-(3-amino-1H-indazol-5-yl)-N-tert-butylbenzenesulfonamide
CID 24963047
4-fluoro-N-(3-methyl-1H-indazol-5-yl)butane-1-sulfonamide
CID 137523337
N-(1H-indazol-6-yl)benzenesulfonamide
CID 2444871
3-phenyl-1H-indazole
CID 300385
4-Amino-N-1H-indazol-6-ylbenzenesulfonamide
CID 83696
N-[4-(3-amino-1H-indazol-6-yl)phenyl]-2-fluorobenzenesulfonamide
CID 118721264
3-(1-Methylpiperidin-4-yl)-5-(phenylsulfonyl)-1h-indazole
CID 24763350
3-(1-methylpiperidin-4-yl)-5-(m-tolylsulfonyl)-1H-indazole
CID 24763354
N-[3-(3-sulfamoylphenyl)-1H-indazol-5-yl]acetamide
CID 53476532
N-[3-(3-sulfamoylphenyl)-1H-indazol-5-yl]thiophene-2-sulfonamide
CID 67456033
N-[4-(6-fluoro-1H-indazol-3-yl)phenyl]methanesulfonamide
CID 155424827
MEK4 inhibitor-1
CID 155424828

Frequently Asked Questions

What is the IUPAC name of 3-(1H-indazol-3-yl)benzenesulfonamide?
The IUPAC name of 3-(1H-indazol-3-yl)benzenesulfonamide (CID 53389592) is 3-(1H-indazol-3-yl)benzenesulfonamide.
What is the SMILES notation for 3-(1H-indazol-3-yl)benzenesulfonamide?
The canonical SMILES for 3-(1H-indazol-3-yl)benzenesulfonamide is NS(=O)(=O)c1cccc(-c2n[nH]c3ccccc23)c1.
What is the InChIKey of 3-(1H-indazol-3-yl)benzenesulfonamide?
The InChIKey is ZHDHTEOEZSHAMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11N3O2S/c14-19(17,18)10-5-3-4-9(8-10)13-11-6-1-2-7-12(11)15-16-13/h1-8H,(H,15,16)(H2,14,17,18).
What are the key properties of 3-(1H-indazol-3-yl)benzenesulfonamide?
3-(1H-indazol-3-yl)benzenesulfonamide has a molecular weight of 273.32 g/mol, XLogP of 1.88, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1H-indazol-3-yl)benzenesulfonamide is sourced from PubChem (CID 53389592), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).