N-[[3-(2-acetamidoethylsulfamoyl)phenyl]methyl]-1-(4-fluorophenyl)indazole-4-carboxamide;N-[[3-(dimethylsulfamoyl)phenyl]methyl]-1-(4-fluorophenyl)indazole-4-carboxamide;N-[[3-(ethylsulfamoyl)phenyl]methyl]-1-(4-fluorophenyl)indazole-4-carboxamide;1-(4-fluorophenyl)-N-[[3-(methylsulfamoyl)phenyl]methyl]indazole-4-carboxamide;1-(4-fluorophenyl)-N-[[3-(propan-2-ylsulfamoyl)phenyl]methyl]indazole-4-carboxamide

C117H108F5N21O16S5 — CID 160747167

IUPACN-[[3-(2-acetamidoethylsulfamoyl)phenyl]methyl]-1-(4-fluorophenyl)indazole-4-carboxamide;N-[[3-(dimethylsulfamoyl)phenyl]methyl]-1-(4-fluorophenyl)indazole-4-carboxamide;N-[[3-(ethylsulfamoyl)phenyl]methyl]-1-(4-fluorophenyl)indazole-4-carboxamide;1-(4-fluorophenyl)-N-[[3-(methylsulfamoyl)phenyl]methyl]indazole-4-carboxamide;1-(4-fluorophenyl)-N-[[3-(propan-2-ylsulfamoyl)phenyl]methyl]indazole-4-carboxamide
SMILESCC(=O)NCCNS(=O)(=O)c1cccc(CNC(=O)c2cccc3c2cnn3-c2ccc(F)cc2)c1.CC(C)NS(=O)(=O)c1cccc(CNC(=O)c2cccc3c2cnn3-c2ccc(F)cc2)c1.CCNS(=O)(=O)c1cccc(CNC(=O)c2cccc3c2cnn3-c2ccc(F)cc2)c1.CN(C)S(=O)(=O)c1cccc(CNC(=O)c2cccc3c2cnn3-c2ccc(F)cc2)c1.CNS(=O)(=O)c1cccc(CNC(=O)c2cccc3c2cnn3-c2ccc(F)cc2)c1
InChIInChI=1S/C25H24FN5O4S.C24H23FN4O3S.2C23H21FN4O3S.C22H19FN4O3S/c1-17(32)27-12-13-30-36(34,35)21-5-2-4-18(14-21)15-28-25(33)22-6-3-7-24-23(22)16-29-31(24)20-10-8-19(26)9-11-20;1-16(2)28-33(31,32)20-6-3-5-17(13-20)14-26-24(30)21-7-4-8-23-22(21)15-27-29(23)19-11-9-18(25)10-12-19;1-27(2)32(30,31)19-6-3-5-16(13-19)14-25-23(29)20-7-4-8-22-21(20)15-26-28(22)18-11-9-17(24)10-12-18;1-2-27-32(30,31)19-6-3-5-16(13-19)14-25-23(29)20-7-4-8-22-21(20)15-26-28(22)18-11-9-17(24)10-12-18;1-24-31(29,30)18-5-2-4-15(12-18)13-25-22(28)19-6-3-7-21-20(19)14-26-27(21)17-10-8-16(23)9-11-17/h2-11,14,16,30H,12-13,15H2,1H3,(H,27,32)(H,28,33);3-13,15-16,28H,14H2,1-2H3,(H,26,30);3-13,15H,14H2,1-2H3,(H,25,29);3-13,15,27H,2,14H2,1H3,(H,25,29);2-12,14,24H,13H2,1H3,(H,25,28)
InChIKeyRWIKBCIVBCSNTM-UHFFFAOYSA-N
MW2319.61 g/mol
LogP16.03
Rot. Bonds35

About N-[[3-(2-acetamidoethylsulfamoyl)phenyl]methyl]-1-(4-fluorophenyl)indazole-4-carboxamide;N-[[3-(dimethylsulfamoyl)phenyl]methyl]-1-(4-fluorophenyl)indazole-4-carboxamide;N-[[3-(ethylsulfamoyl)phenyl]methyl]-1-(4-fluorophenyl)indazole-4-carboxamide;1-(4-fluorophenyl)-N-[[3-(methylsulfamoyl)phenyl]methyl]indazole-4-carboxamide;1-(4-fluorophenyl)-N-[[3-(propan-2-ylsulfamoyl)phenyl]methyl]indazole-4-carboxamide

N-[[3-(2-acetamidoethylsulfamoyl)phenyl]methyl]-1-(4-fluorophenyl)indazole-4-carboxamide;N-[[3-(dimethylsulfamoyl)phenyl]methyl]-1-(4-fluorophenyl)indazole-4-carboxamide;N-[[3-(ethylsulfamoyl)phenyl]methyl]-1-(4-fluorophenyl)indazole-4-carboxamide;1-(4-fluorophenyl)-N-[[3-(methylsulfamoyl)phenyl]methyl]indazole-4-carboxamide;1-(4-fluorophenyl)-N-[[3-(propan-2-ylsulfamoyl)phenyl]methyl]indazole-4-carboxamide (PubChem CID 160747167) has the molecular formula C117H108F5N21O16S5 and a molecular weight of 2319.61 g/mol. Its IUPAC name is N-[[3-(2-acetamidoethylsulfamoyl)phenyl]methyl]-1-(4-fluorophenyl)indazole-4-carboxamide;N-[[3-(dimethylsulfamoyl)phenyl]methyl]-1-(4-fluorophenyl)indazole-4-carboxamide;N-[[3-(ethylsulfamoyl)phenyl]methyl]-1-(4-fluorophenyl)indazole-4-carboxamide;1-(4-fluorophenyl)-N-[[3-(methylsulfamoyl)phenyl]methyl]indazole-4-carboxamide;1-(4-fluorophenyl)-N-[[3-(propan-2-ylsulfamoyl)phenyl]methyl]indazole-4-carboxamide.

Molecular Properties

Compound NameN-[[3-(2-acetamidoethylsulfamoyl)phenyl]methyl]-1-(4-fluorophenyl)indazole-4-carboxamide;N-[[3-(dimethylsulfamoyl)phenyl]methyl]-1-(4-fluorophenyl)indazole-4-carboxamide;N-[[3-(ethylsulfamoyl)phenyl]methyl]-1-(4-fluorophenyl)indazole-4-carboxamide;1-(4-fluorophenyl)-N-[[3-(methylsulfamoyl)phenyl]methyl]indazole-4-carboxamide;1-(4-fluorophenyl)-N-[[3-(propan-2-ylsulfamoyl)phenyl]methyl]indazole-4-carboxamide
PubChem CID160747167
Molecular FormulaC117H108F5N21O16S5
Molecular Weight2319.61 g/mol
Exact Mass2317.68
IUPAC NameN-[[3-(2-acetamidoethylsulfamoyl)phenyl]methyl]-1-(4-fluorophenyl)indazole-4-carboxamide;N-[[3-(dimethylsulfamoyl)phenyl]methyl]-1-(4-fluorophenyl)indazole-4-carboxamide;N-[[3-(ethylsulfamoyl)phenyl]methyl]-1-(4-fluorophenyl)indazole-4-carboxamide;1-(4-fluorophenyl)-N-[[3-(methylsulfamoyl)phenyl]methyl]indazole-4-carboxamide;1-(4-fluorophenyl)-N-[[3-(propan-2-ylsulfamoyl)phenyl]methyl]indazole-4-carboxamide
SMILESCC(=O)NCCNS(=O)(=O)c1cccc(CNC(=O)c2cccc3c2cnn3-c2ccc(F)cc2)c1.CC(C)NS(=O)(=O)c1cccc(CNC(=O)c2cccc3c2cnn3-c2ccc(F)cc2)c1.CCNS(=O)(=O)c1cccc(CNC(=O)c2cccc3c2cnn3-c2ccc(F)cc2)c1.CN(C)S(=O)(=O)c1cccc(CNC(=O)c2cccc3c2cnn3-c2ccc(F)cc2)c1.CNS(=O)(=O)c1cccc(CNC(=O)c2cccc3c2cnn3-c2ccc(F)cc2)c1
InChIInChI=1S/C25H24FN5O4S.C24H23FN4O3S.2C23H21FN4O3S.C22H19FN4O3S/c1-17(32)27-12-13-30-36(34,35)21-5-2-4-18(14-21)15-28-25(33)22-6-3-7-24-23(22)16-29-31(24)20-10-8-19(26)9-11-20;1-16(2)28-33(31,32)20-6-3-5-17(13-20)14-26-24(30)21-7-4-8-23-22(21)15-27-29(23)19-11-9-18(25)10-12-19;1-27(2)32(30,31)19-6-3-5-16(13-19)14-25-23(29)20-7-4-8-22-21(20)15-26-28(22)18-11-9-17(24)10-12-18;1-2-27-32(30,31)19-6-3-5-16(13-19)14-25-23(29)20-7-4-8-22-21(20)15-26-28(22)18-11-9-17(24)10-12-18;1-24-31(29,30)18-5-2-4-15(12-18)13-25-22(28)19-6-3-7-21-20(19)14-26-27(21)17-10-8-16(23)9-11-17/h2-11,14,16,30H,12-13,15H2,1H3,(H,27,32)(H,28,33);3-13,15-16,28H,14H2,1-2H3,(H,26,30);3-13,15H,14H2,1-2H3,(H,25,29);3-13,15,27H,2,14H2,1H3,(H,25,29);2-12,14,24H,13H2,1H3,(H,25,28)
InChIKeyRWIKBCIVBCSNTM-UHFFFAOYSA-N
XLogP16.03
TPSA485.76 Ų
H-Bond Donors10
H-Bond Acceptors26
Rotatable Bonds35
Heavy Atoms164
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002319.61
LogP ≤ 516.03
H-Bond Donors ≤ 510
H-Bond Acceptors ≤ 1026

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze N-[[3-(2-acetamidoethylsulfamoyl)phenyl]methyl]-1-(4-fluorophenyl)indazole-4-carboxamide;N-[[3-(dimethylsulfamoyl)phenyl]methyl]-1-(4-fluorophenyl)indazole-4-carboxamide;N-[[3-(ethylsulfamoyl)phenyl]methyl]-1-(4-fluorophenyl)indazole-4-carboxamide;1-(4-fluorophenyl)-N-[[3-(methylsulfamoyl)phenyl]methyl]indazole-4-carboxamide;1-(4-fluorophenyl)-N-[[3-(propan-2-ylsulfamoyl)phenyl]methyl]indazole-4-carboxamide with MolForge

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Related Compounds

N-[[3-(dimethylsulfamoyl)phenyl]methyl]-1-(4-fluorophenyl)indazole-4-carboxamide
CID 44469942
1-(4-fluorophenyl)-N-[[3-(methylsulfamoyl)phenyl]methyl]indazole-4-carboxamide
CID 58138841
N-[[3-(ethylsulfamoyl)phenyl]methyl]-1-(4-fluorophenyl)indazole-4-carboxamide
CID 58138852
1-(4-fluorophenyl)-N-[[3-(propan-2-ylsulfamoyl)phenyl]methyl]indazole-4-carboxamide
CID 58138893
N-[[4-(2-acetamidoethylsulfamoyl)phenyl]methyl]-1-(4-fluorophenyl)indazole-4-carboxamide
CID 44470085
1-(4-fluorophenyl)-N-[[4-[2-(methylamino)ethylsulfamoyl]phenyl]methyl]indazole-4-carboxamide
CID 58138782
N-[[3-(2-acetamidoethylsulfamoyl)phenyl]methyl]-1-(4-fluorophenyl)indazole-4-carboxamide
CID 58138848
3-[4-[4-(difluoromethyl)phenyl]-5-fluoro-2-pyridinyl]-1-[(2S,4R)-4-fluoro-1-(4-fluorophenyl)sulfonylpyrrolidin-2-yl]propan-1-one;(2S,4R)-4-fluoro-N-[[3-fluoro-5-[2-oxo-4-(trifluoromethyl)-1-pyridinyl]phenyl]methyl]-1-(4-fluorophenyl)sulfonylpyrrolidine-2-carboxamide;(2S,4R)-4-fluoro-1-(4-fluorophenyl)sulfonyl-N-[[3-fluoro-5-[3-(trifluoromethyl)pyrazol-1-yl]phenyl]methyl]pyrrolidine-2-carboxamide;(2S,4R)-4-fluoro-1-(4-fluorophenyl)sulfonyl-N-[[3-fluoro-5-[4-(trifluoromethyl)pyrazol-1-yl]phenyl]methyl]pyrrolidine-2-carboxamide
CID 157328967
(5R)-5-[4-[1-(benzenesulfonyl)indol-5-yl]phenyl]-5-[(5-fluoro-3-oxo-1H-isoindol-2-yl)methyl]imidazolidine-2,4-dione;(5R)-5-[(5-fluoro-3-oxo-1H-isoindol-2-yl)methyl]-5-[4-(1H-indazol-6-yl)phenyl]imidazolidine-2,4-dione;(5R)-5-[(5-fluoro-3-oxo-1H-isoindol-2-yl)methyl]-5-[4-(1H-indol-3-yl)phenyl]imidazolidine-2,4-dione;(5R)-5-[(5-fluoro-3-oxo-1H-isoindol-2-yl)methyl]-5-[4-(3-methyl-2H-indazol-5-yl)phenyl]imidazolidine-2,4-dione
CID 157175821
6-cyano-1-(4-fluorophenyl)-N-[[4-(methylsulfamoyl)phenyl]methyl]indazole-4-carboxamide;1-(4-fluorophenyl)-N-[[4-(2-methoxyethylsulfamoyl)phenyl]methyl]indazole-4-carboxamide;1-(4-fluorophenyl)-6-methyl-N-[[4-(methylsulfamoyl)phenyl]methyl]indazole-4-carboxamide;1-(4-fluorophenyl)-N-[[4-(methylsulfamoyl)phenyl]methyl]-6-methylsulfonylindazole-4-carboxamide;1-(4-fluorophenyl)-N-[[4-(propan-2-ylsulfamoyl)phenyl]methyl]indazole-4-carboxamide
CID 157227479
4-[3-(difluoromethyl)-5-(3-fluoro-4-methylphenyl)pyrazol-1-yl]benzenesulfonamide;4-(4-methyl-5-phenylpyrazol-1-yl)benzenesulfonamide;N-methyl-4-phenyl-1-(4-sulfamoylphenyl)pyrazole-3-carboxamide;4-(3-methyl-5-piperidin-4-ylpyrazol-1-yl)benzenesulfonamide
CID 157458833
2-[(2S)-2-amino-3-[1-(4-methylphenyl)sulfonylindazol-5-yl]propyl]isoindole-1,3-dione;2-[(2S)-2-(dimethylamino)-3-[1-(4-methylphenyl)sulfonylindazol-5-yl]propyl]isoindole-1,3-dione;(2S)-2-N,2-N-dimethyl-3-[1-(4-methylphenyl)sulfonylindazol-5-yl]propane-1,2-diamine
CID 157659635

Frequently Asked Questions

What is the IUPAC name of N-[[3-(2-acetamidoethylsulfamoyl)phenyl]methyl]-1-(4-fluorophenyl)indazole-4-carboxamide;N-[[3-(dimethylsulfamoyl)phenyl]methyl]-1-(4-fluorophenyl)indazole-4-carboxamide;N-[[3-(ethylsulfamoyl)phenyl]methyl]-1-(4-fluorophenyl)indazole-4-carboxamide;1-(4-fluorophenyl)-N-[[3-(methylsulfamoyl)phenyl]methyl]indazole-4-carboxamide;1-(4-fluorophenyl)-N-[[3-(propan-2-ylsulfamoyl)phenyl]methyl]indazole-4-carboxamide?
The IUPAC name of N-[[3-(2-acetamidoethylsulfamoyl)phenyl]methyl]-1-(4-fluorophenyl)indazole-4-carboxamide;N-[[3-(dimethylsulfamoyl)phenyl]methyl]-1-(4-fluorophenyl)indazole-4-carboxamide;N-[[3-(ethylsulfamoyl)phenyl]methyl]-1-(4-fluorophenyl)indazole-4-carboxamide;1-(4-fluorophenyl)-N-[[3-(methylsulfamoyl)phenyl]methyl]indazole-4-carboxamide;1-(4-fluorophenyl)-N-[[3-(propan-2-ylsulfamoyl)phenyl]methyl]indazole-4-carboxamide (CID 160747167) is N-[[3-(2-acetamidoethylsulfamoyl)phenyl]methyl]-1-(4-fluorophenyl)indazole-4-carboxamide;N-[[3-(dimethylsulfamoyl)phenyl]methyl]-1-(4-fluorophenyl)indazole-4-carboxamide;N-[[3-(ethylsulfamoyl)phenyl]methyl]-1-(4-fluorophenyl)indazole-4-carboxamide;1-(4-fluorophenyl)-N-[[3-(methylsulfamoyl)phenyl]methyl]indazole-4-carboxamide;1-(4-fluorophenyl)-N-[[3-(propan-2-ylsulfamoyl)phenyl]methyl]indazole-4-carboxamide.
What is the SMILES notation for N-[[3-(2-acetamidoethylsulfamoyl)phenyl]methyl]-1-(4-fluorophenyl)indazole-4-carboxamide;N-[[3-(dimethylsulfamoyl)phenyl]methyl]-1-(4-fluorophenyl)indazole-4-carboxamide;N-[[3-(ethylsulfamoyl)phenyl]methyl]-1-(4-fluorophenyl)indazole-4-carboxamide;1-(4-fluorophenyl)-N-[[3-(methylsulfamoyl)phenyl]methyl]indazole-4-carboxamide;1-(4-fluorophenyl)-N-[[3-(propan-2-ylsulfamoyl)phenyl]methyl]indazole-4-carboxamide?
The canonical SMILES for N-[[3-(2-acetamidoethylsulfamoyl)phenyl]methyl]-1-(4-fluorophenyl)indazole-4-carboxamide;N-[[3-(dimethylsulfamoyl)phenyl]methyl]-1-(4-fluorophenyl)indazole-4-carboxamide;N-[[3-(ethylsulfamoyl)phenyl]methyl]-1-(4-fluorophenyl)indazole-4-carboxamide;1-(4-fluorophenyl)-N-[[3-(methylsulfamoyl)phenyl]methyl]indazole-4-carboxamide;1-(4-fluorophenyl)-N-[[3-(propan-2-ylsulfamoyl)phenyl]methyl]indazole-4-carboxamide is CC(=O)NCCNS(=O)(=O)c1cccc(CNC(=O)c2cccc3c2cnn3-c2ccc(F)cc2)c1.CC(C)NS(=O)(=O)c1cccc(CNC(=O)c2cccc3c2cnn3-c2ccc(F)cc2)c1.CCNS(=O)(=O)c1cccc(CNC(=O)c2cccc3c2cnn3-c2ccc(F)cc2)c1.CN(C)S(=O)(=O)c1cccc(CNC(=O)c2cccc3c2cnn3-c2ccc(F)cc2)c1.CNS(=O)(=O)c1cccc(CNC(=O)c2cccc3c2cnn3-c2ccc(F)cc2)c1.
What is the InChIKey of N-[[3-(2-acetamidoethylsulfamoyl)phenyl]methyl]-1-(4-fluorophenyl)indazole-4-carboxamide;N-[[3-(dimethylsulfamoyl)phenyl]methyl]-1-(4-fluorophenyl)indazole-4-carboxamide;N-[[3-(ethylsulfamoyl)phenyl]methyl]-1-(4-fluorophenyl)indazole-4-carboxamide;1-(4-fluorophenyl)-N-[[3-(methylsulfamoyl)phenyl]methyl]indazole-4-carboxamide;1-(4-fluorophenyl)-N-[[3-(propan-2-ylsulfamoyl)phenyl]methyl]indazole-4-carboxamide?
The InChIKey is RWIKBCIVBCSNTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H24FN5O4S.C24H23FN4O3S.2C23H21FN4O3S.C22H19FN4O3S/c1-17(32)27-12-13-30-36(34,35)21-5-2-4-18(14-21)15-28-25(33)22-6-3-7-24-23(22)16-29-31(24)20-10-8-19(26)9-11-20;1-16(2)28-33(31,32)20-6-3-5-17(13-20)14-26-24(30)21-7-4-8-23-22(21)15-27-29(23)19-11-9-18(25)10-12-19;1-27(2)32(30,31)19-6-3-5-16(13-19)14-25-23(29)20-7-4-8-22-21(20)15-26-28(22)18-11-9-17(24)10-12-18;1-2-27-32(30,31)19-6-3-5-16(13-19)14-25-23(29)20-7-4-8-22-21(20)15-26-28(22)18-11-9-17(24)10-12-18;1-24-31(29,30)18-5-2-4-15(12-18)13-25-22(28)19-6-3-7-21-20(19)14-26-27(21)17-10-8-16(23)9-11-17/h2-11,14,16,30H,12-13,15H2,1H3,(H,27,32)(H,28,33);3-13,15-16,28H,14H2,1-2H3,(H,26,30);3-13,15H,14H2,1-2H3,(H,25,29);3-13,15,27H,2,14H2,1H3,(H,25,29);2-12,14,24H,13H2,1H3,(H,25,28).
What are the key properties of N-[[3-(2-acetamidoethylsulfamoyl)phenyl]methyl]-1-(4-fluorophenyl)indazole-4-carboxamide;N-[[3-(dimethylsulfamoyl)phenyl]methyl]-1-(4-fluorophenyl)indazole-4-carboxamide;N-[[3-(ethylsulfamoyl)phenyl]methyl]-1-(4-fluorophenyl)indazole-4-carboxamide;1-(4-fluorophenyl)-N-[[3-(methylsulfamoyl)phenyl]methyl]indazole-4-carboxamide;1-(4-fluorophenyl)-N-[[3-(propan-2-ylsulfamoyl)phenyl]methyl]indazole-4-carboxamide?
N-[[3-(2-acetamidoethylsulfamoyl)phenyl]methyl]-1-(4-fluorophenyl)indazole-4-carboxamide;N-[[3-(dimethylsulfamoyl)phenyl]methyl]-1-(4-fluorophenyl)indazole-4-carboxamide;N-[[3-(ethylsulfamoyl)phenyl]methyl]-1-(4-fluorophenyl)indazole-4-carboxamide;1-(4-fluorophenyl)-N-[[3-(methylsulfamoyl)phenyl]methyl]indazole-4-carboxamide;1-(4-fluorophenyl)-N-[[3-(propan-2-ylsulfamoyl)phenyl]methyl]indazole-4-carboxamide has a molecular weight of 2319.61 g/mol, XLogP of 16.03, 35 rotatable bonds, 10 hydrogen bond donors, and 26 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[3-(2-acetamidoethylsulfamoyl)phenyl]methyl]-1-(4-fluorophenyl)indazole-4-carboxamide;N-[[3-(dimethylsulfamoyl)phenyl]methyl]-1-(4-fluorophenyl)indazole-4-carboxamide;N-[[3-(ethylsulfamoyl)phenyl]methyl]-1-(4-fluorophenyl)indazole-4-carboxamide;1-(4-fluorophenyl)-N-[[3-(methylsulfamoyl)phenyl]methyl]indazole-4-carboxamide;1-(4-fluorophenyl)-N-[[3-(propan-2-ylsulfamoyl)phenyl]methyl]indazole-4-carboxamide is sourced from PubChem (CID 160747167), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).