2-[(4-fluorophenyl)sulfonylamino]-N-(1H-indazol-6-yl)benzamide

C20H15FN4O3S — CID 2361886

IUPAC2-[(4-fluorophenyl)sulfonylamino]-N-(1H-indazol-6-yl)benzamide
SMILESO=C(Nc1ccc2cn[nH]c2c1)c1ccccc1NS(=O)(=O)c1ccc(F)cc1
InChIInChI=1S/C20H15FN4O3S/c21-14-6-9-16(10-7-14)29(27,28)25-18-4-2-1-3-17(18)20(26)23-15-8-5-13-12-22-24-19(13)11-15/h1-12,25H,(H,22,24)(H,23,26)
InChIKeyZRPRGVRWWLMGAF-UHFFFAOYSA-N
MW410.43 g/mol
LogP3.76
Rot. Bonds5

About 2-[(4-fluorophenyl)sulfonylamino]-N-(1H-indazol-6-yl)benzamide

2-[(4-fluorophenyl)sulfonylamino]-N-(1H-indazol-6-yl)benzamide (PubChem CID 2361886) has the molecular formula C20H15FN4O3S and a molecular weight of 410.43 g/mol. Its IUPAC name is 2-[(4-fluorophenyl)sulfonylamino]-N-(1H-indazol-6-yl)benzamide.

Molecular Properties

Compound Name2-[(4-fluorophenyl)sulfonylamino]-N-(1H-indazol-6-yl)benzamide
PubChem CID2361886
Molecular FormulaC20H15FN4O3S
Molecular Weight410.43 g/mol
Exact Mass410.08
IUPAC Name2-[(4-fluorophenyl)sulfonylamino]-N-(1H-indazol-6-yl)benzamide
SMILESO=C(Nc1ccc2cn[nH]c2c1)c1ccccc1NS(=O)(=O)c1ccc(F)cc1
InChIInChI=1S/C20H15FN4O3S/c21-14-6-9-16(10-7-14)29(27,28)25-18-4-2-1-3-17(18)20(26)23-15-8-5-13-12-22-24-19(13)11-15/h1-12,25H,(H,22,24)(H,23,26)
InChIKeyZRPRGVRWWLMGAF-UHFFFAOYSA-N
XLogP3.76
TPSA103.95 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500410.43
LogP ≤ 53.76
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-{4-[(1H-indazol-4-ylamino)sulfonyl]phenyl}acetamide
CID 1481964
N-Benzyl-N-(1H-pyrazol-3-ylmethyl)-2-(toluene-4-sulfonylamino)-benzamide
CID 44328272
N-[[3-(ethylsulfamoyl)phenyl]methyl]-1-(4-fluorophenyl)indazole-4-carboxamide
CID 58138852
N-benzyl-3-(3-sulfamoylphenyl)-1H-indazole-5-carboxamide
CID 67457022
N-[[3-(3-sulfamoylphenyl)-1H-indazol-5-yl]methyl]benzamide
CID 67462136
MEK4 inhibitor-2
CID 163321142
4-fluoro-N-(1H-indazol-4-yl)benzamide
CID 1482886
N-(1H-indazol-6-yl)-4-methyl-3-morpholin-4-ylsulfonylbenzamide
CID 2345132
N-(1H-indazol-6-yl)-2-methyl-5-piperidin-1-ylsulfonylbenzamide
CID 2346076
2-fluoro-N-(1H-indazol-6-yl)benzamide
CID 2353882
N-(1H-indazol-6-yl)-4-methyl-3-piperidin-1-ylsulfonylbenzamide
CID 2374283
N-(1H-indazol-6-yl)-4-oxo-1H-quinoline-3-carboxamide
CID 66674872

Frequently Asked Questions

What is the IUPAC name of 2-[(4-fluorophenyl)sulfonylamino]-N-(1H-indazol-6-yl)benzamide?
The IUPAC name of 2-[(4-fluorophenyl)sulfonylamino]-N-(1H-indazol-6-yl)benzamide (CID 2361886) is 2-[(4-fluorophenyl)sulfonylamino]-N-(1H-indazol-6-yl)benzamide.
What is the SMILES notation for 2-[(4-fluorophenyl)sulfonylamino]-N-(1H-indazol-6-yl)benzamide?
The canonical SMILES for 2-[(4-fluorophenyl)sulfonylamino]-N-(1H-indazol-6-yl)benzamide is O=C(Nc1ccc2cn[nH]c2c1)c1ccccc1NS(=O)(=O)c1ccc(F)cc1.
What is the InChIKey of 2-[(4-fluorophenyl)sulfonylamino]-N-(1H-indazol-6-yl)benzamide?
The InChIKey is ZRPRGVRWWLMGAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15FN4O3S/c21-14-6-9-16(10-7-14)29(27,28)25-18-4-2-1-3-17(18)20(26)23-15-8-5-13-12-22-24-19(13)11-15/h1-12,25H,(H,22,24)(H,23,26).
What are the key properties of 2-[(4-fluorophenyl)sulfonylamino]-N-(1H-indazol-6-yl)benzamide?
2-[(4-fluorophenyl)sulfonylamino]-N-(1H-indazol-6-yl)benzamide has a molecular weight of 410.43 g/mol, XLogP of 3.76, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-fluorophenyl)sulfonylamino]-N-(1H-indazol-6-yl)benzamide is sourced from PubChem (CID 2361886), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).