5-(1H-indazol-5-ylsulfamoyl)-1H-pyrazole-4-carboxylic acid

C11H9N5O4S — CID 60912281

IUPAC5-(1H-indazol-5-ylsulfamoyl)-1H-pyrazole-4-carboxylic acid
SMILESO=C(O)c1cn[nH]c1S(=O)(=O)Nc1ccc2[nH]ncc2c1
InChIInChI=1S/C11H9N5O4S/c17-11(18)8-5-13-15-10(8)21(19,20)16-7-1-2-9-6(3-7)4-12-14-9/h1-5,16H,(H,12,14)(H,13,15)(H,17,18)
InChIKeyLMMDYIVMNBWLEG-UHFFFAOYSA-N
MW307.29 g/mol
LogP0.79
Rot. Bonds4

About 5-(1H-indazol-5-ylsulfamoyl)-1H-pyrazole-4-carboxylic acid

5-(1H-indazol-5-ylsulfamoyl)-1H-pyrazole-4-carboxylic acid (PubChem CID 60912281) has the molecular formula C11H9N5O4S and a molecular weight of 307.29 g/mol. Its IUPAC name is 5-(1H-indazol-5-ylsulfamoyl)-1H-pyrazole-4-carboxylic acid.

Molecular Properties

Compound Name5-(1H-indazol-5-ylsulfamoyl)-1H-pyrazole-4-carboxylic acid
PubChem CID60912281
Molecular FormulaC11H9N5O4S
Molecular Weight307.29 g/mol
Exact Mass307.04
IUPAC Name5-(1H-indazol-5-ylsulfamoyl)-1H-pyrazole-4-carboxylic acid
SMILESO=C(O)c1cn[nH]c1S(=O)(=O)Nc1ccc2[nH]ncc2c1
InChIInChI=1S/C11H9N5O4S/c17-11(18)8-5-13-15-10(8)21(19,20)16-7-1-2-9-6(3-7)4-12-14-9/h1-5,16H,(H,12,14)(H,13,15)(H,17,18)
InChIKeyLMMDYIVMNBWLEG-UHFFFAOYSA-N
XLogP0.79
TPSA140.83 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.29
LogP ≤ 50.79
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

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Related Compounds

5-[(4-methylphenyl)sulfamoyl]-1H-pyrazole-4-carboxylic acid
CID 54934211
5-[(4-fluoro-3-methylphenyl)sulfamoyl]-1H-pyrazole-4-carboxylic acid
CID 62811098
5-(1H-indazol-5-ylsulfamoyl)thiophene-3-carboxylic acid
CID 39832395
5-[(3-fluorophenyl)sulfamoyl]-1H-pyrazole-4-carboxylic acid
CID 54934258
5-[(3-ethynylphenyl)sulfamoyl]-1H-pyrazole-4-carboxylic acid
CID 60910898
5-(thiophen-3-ylsulfamoyl)-1H-pyrazole-4-carboxylic acid
CID 66351046
methyl 4-(1H-indazol-5-ylsulfamoyl)benzoate
CID 40687663
5-[(3,5-dichloro-4-fluorophenyl)sulfamoyl]-1H-pyrazole-4-carboxylic acid
CID 107571644
5-[(3-fluoro-5-methylphenyl)sulfamoyl]-1H-pyrazole-4-carboxylic acid
CID 79054686
N-(1H-indazol-5-yl)-1,3-thiazole-5-sulfonamide
CID 140564692
N-(1H-indazol-5-yl)-4-nitrobenzenesulfonamide
CID 39832274
5-[(4-fluorophenyl)sulfamoyl]-N-methyl-1H-pyrazole-4-carboxamide
CID 53115687

Frequently Asked Questions

What is the IUPAC name of 5-(1H-indazol-5-ylsulfamoyl)-1H-pyrazole-4-carboxylic acid?
The IUPAC name of 5-(1H-indazol-5-ylsulfamoyl)-1H-pyrazole-4-carboxylic acid (CID 60912281) is 5-(1H-indazol-5-ylsulfamoyl)-1H-pyrazole-4-carboxylic acid.
What is the SMILES notation for 5-(1H-indazol-5-ylsulfamoyl)-1H-pyrazole-4-carboxylic acid?
The canonical SMILES for 5-(1H-indazol-5-ylsulfamoyl)-1H-pyrazole-4-carboxylic acid is O=C(O)c1cn[nH]c1S(=O)(=O)Nc1ccc2[nH]ncc2c1.
What is the InChIKey of 5-(1H-indazol-5-ylsulfamoyl)-1H-pyrazole-4-carboxylic acid?
The InChIKey is LMMDYIVMNBWLEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9N5O4S/c17-11(18)8-5-13-15-10(8)21(19,20)16-7-1-2-9-6(3-7)4-12-14-9/h1-5,16H,(H,12,14)(H,13,15)(H,17,18).
What are the key properties of 5-(1H-indazol-5-ylsulfamoyl)-1H-pyrazole-4-carboxylic acid?
5-(1H-indazol-5-ylsulfamoyl)-1H-pyrazole-4-carboxylic acid has a molecular weight of 307.29 g/mol, XLogP of 0.79, 4 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1H-indazol-5-ylsulfamoyl)-1H-pyrazole-4-carboxylic acid is sourced from PubChem (CID 60912281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).