4-[4-(benzenesulfonyl)piperazin-1-yl]-1H-indazole;4-(4-cyclopentylsulfonylpiperazin-1-yl)-1H-indazole;4-(4-propylsulfonylpiperazin-1-yl)-1H-indazole;4-[4-(2,2,2-trifluoroethylsulfonyl)piperazin-1-yl]-1H-indazole

C60H75F3N16O8S4 — CID 162152140

IUPAC4-[4-(benzenesulfonyl)piperazin-1-yl]-1H-indazole;4-(4-cyclopentylsulfonylpiperazin-1-yl)-1H-indazole;4-(4-propylsulfonylpiperazin-1-yl)-1H-indazole;4-[4-(2,2,2-trifluoroethylsulfonyl)piperazin-1-yl]-1H-indazole
SMILESCCCS(=O)(=O)N1CCN(c2cccc3[nH]ncc23)CC1.O=S(=O)(C1CCCC1)N1CCN(c2cccc3[nH]ncc23)CC1.O=S(=O)(CC(F)(F)F)N1CCN(c2cccc3[nH]ncc23)CC1.O=S(=O)(c1ccccc1)N1CCN(c2cccc3[nH]ncc23)CC1
InChIInChI=1S/C17H18N4O2S.C16H22N4O2S.C14H20N4O2S.C13H15F3N4O2S/c22-24(23,14-5-2-1-3-6-14)21-11-9-20(10-12-21)17-8-4-7-16-15(17)13-18-19-16;21-23(22,13-4-1-2-5-13)20-10-8-19(9-11-20)16-7-3-6-15-14(16)12-17-18-15;1-2-10-21(19,20)18-8-6-17(7-9-18)14-5-3-4-13-12(14)11-15-16-13;14-13(15,16)9-23(21,22)20-6-4-19(5-7-20)12-3-1-2-11-10(12)8-17-18-11/h1-8,13H,9-12H2,(H,18,19);3,6-7,12-13H,1-2,4-5,8-11H2,(H,17,18);3-5,11H,2,6-10H2,1H3,(H,15,16);1-3,8H,4-7,9H2,(H,17,18)
InChIKeyZLIXEBCAIBRTBI-UHFFFAOYSA-N
MW1333.63 g/mol
LogP7.03
Rot. Bonds13

About 4-[4-(benzenesulfonyl)piperazin-1-yl]-1H-indazole;4-(4-cyclopentylsulfonylpiperazin-1-yl)-1H-indazole;4-(4-propylsulfonylpiperazin-1-yl)-1H-indazole;4-[4-(2,2,2-trifluoroethylsulfonyl)piperazin-1-yl]-1H-indazole

4-[4-(benzenesulfonyl)piperazin-1-yl]-1H-indazole;4-(4-cyclopentylsulfonylpiperazin-1-yl)-1H-indazole;4-(4-propylsulfonylpiperazin-1-yl)-1H-indazole;4-[4-(2,2,2-trifluoroethylsulfonyl)piperazin-1-yl]-1H-indazole (PubChem CID 162152140) has the molecular formula C60H75F3N16O8S4 and a molecular weight of 1333.63 g/mol. Its IUPAC name is 4-[4-(benzenesulfonyl)piperazin-1-yl]-1H-indazole;4-(4-cyclopentylsulfonylpiperazin-1-yl)-1H-indazole;4-(4-propylsulfonylpiperazin-1-yl)-1H-indazole;4-[4-(2,2,2-trifluoroethylsulfonyl)piperazin-1-yl]-1H-indazole.

Molecular Properties

Compound Name4-[4-(benzenesulfonyl)piperazin-1-yl]-1H-indazole;4-(4-cyclopentylsulfonylpiperazin-1-yl)-1H-indazole;4-(4-propylsulfonylpiperazin-1-yl)-1H-indazole;4-[4-(2,2,2-trifluoroethylsulfonyl)piperazin-1-yl]-1H-indazole
PubChem CID162152140
Molecular FormulaC60H75F3N16O8S4
Molecular Weight1333.63 g/mol
Exact Mass1332.48
IUPAC Name4-[4-(benzenesulfonyl)piperazin-1-yl]-1H-indazole;4-(4-cyclopentylsulfonylpiperazin-1-yl)-1H-indazole;4-(4-propylsulfonylpiperazin-1-yl)-1H-indazole;4-[4-(2,2,2-trifluoroethylsulfonyl)piperazin-1-yl]-1H-indazole
SMILESCCCS(=O)(=O)N1CCN(c2cccc3[nH]ncc23)CC1.O=S(=O)(C1CCCC1)N1CCN(c2cccc3[nH]ncc23)CC1.O=S(=O)(CC(F)(F)F)N1CCN(c2cccc3[nH]ncc23)CC1.O=S(=O)(c1ccccc1)N1CCN(c2cccc3[nH]ncc23)CC1
InChIInChI=1S/C17H18N4O2S.C16H22N4O2S.C14H20N4O2S.C13H15F3N4O2S/c22-24(23,14-5-2-1-3-6-14)21-11-9-20(10-12-21)17-8-4-7-16-15(17)13-18-19-16;21-23(22,13-4-1-2-5-13)20-10-8-19(9-11-20)16-7-3-6-15-14(16)12-17-18-15;1-2-10-21(19,20)18-8-6-17(7-9-18)14-5-3-4-13-12(14)11-15-16-13;14-13(15,16)9-23(21,22)20-6-4-19(5-7-20)12-3-1-2-11-10(12)8-17-18-11/h1-8,13H,9-12H2,(H,18,19);3,6-7,12-13H,1-2,4-5,8-11H2,(H,17,18);3-5,11H,2,6-10H2,1H3,(H,15,16);1-3,8H,4-7,9H2,(H,17,18)
InChIKeyZLIXEBCAIBRTBI-UHFFFAOYSA-N
XLogP7.03
TPSA277.20 Ų
H-Bond Donors4
H-Bond Acceptors16
Rotatable Bonds13
Heavy Atoms91
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001333.63
LogP ≤ 57.03
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1016

Analyze 4-[4-(benzenesulfonyl)piperazin-1-yl]-1H-indazole;4-(4-cyclopentylsulfonylpiperazin-1-yl)-1H-indazole;4-(4-propylsulfonylpiperazin-1-yl)-1H-indazole;4-[4-(2,2,2-trifluoroethylsulfonyl)piperazin-1-yl]-1H-indazole with MolForge

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Related Compounds

4-(4-cyclopentylsulfonylpiperazin-1-yl)-1H-indazole;4-(4-cyclopropylsulfonylpiperazin-1-yl)-1H-indazole;4-(4-propylsulfonylpiperazin-1-yl)-1H-indazole;4-[4-(2,2,2-trifluoroethylsulfonyl)piperazin-1-yl]-1H-indazole
CID 157294164
4-(4-cyclopentylsulfonylpiperazin-1-yl)-1H-indazole;4-(4-cyclopropylsulfonylpiperazin-1-yl)-1H-indazole;4-(1H-indazol-4-yl)piperazine-1-sulfonamide;4-[4-(2,2,2-trifluoroethylsulfonyl)piperazin-1-yl]-1H-indazole
CID 157316412
4-(4-cyclopropylsulfonylpiperazin-1-yl)-1H-indazole;4-(1H-indazol-4-yl)-N,N-dimethylpiperazine-1-sulfonamide;4-(1H-indazol-4-yl)piperazine-1-sulfonamide;4-[4-(2,2,2-trifluoroethylsulfonyl)piperazin-1-yl]-1H-indazole
CID 158149759
1-[[1-(benzenesulfonyl)piperidin-4-yl]methyl]-5-(1H-pyrazol-4-yl)indole;1-[(1-benzylsulfonylpiperidin-4-yl)methyl]-5-(1H-pyrazol-4-yl)indole;1-[[1-(2-phenylethylsulfonyl)piperidin-4-yl]methyl]-5-(1H-pyrazol-4-yl)indole;5-(1H-pyrazol-4-yl)-1-[(1-pyridin-2-ylsulfonylpiperidin-4-yl)methyl]indole;5-(1H-pyrazol-4-yl)-1-[[1-(2,2,2-trifluoroethylsulfonyl)piperidin-4-yl]methyl]indole
CID 159364559
1-[4-(6-fluoro-1H-indazol-4-yl)piperazin-1-yl]ethanone;7-(1H-indazol-4-yl)-2-methyl-5,6,8,8a-tetrahydro-1H-imidazo[1,5-a]pyrazin-3-one;4-(4-methylsulfonylpiperazin-1-yl)-6-(trifluoromethyl)-1H-indazole;1-[4-[6-(trifluoromethyl)-1H-indazol-4-yl]piperazin-1-yl]ethanone
CID 160985795
1-[4-(6-fluoro-1H-indazol-4-yl)piperazin-1-yl]ethanone;4-(4-methylsulfonylpiperazin-1-yl)-6-(trifluoromethyl)-1H-indazole;N-(2-phenylethyl)-1H-indazol-4-amine;1-[4-[6-(trifluoromethyl)-1H-indazol-4-yl]piperazin-1-yl]ethanone
CID 161369980
4-[4-(benzenesulfonyl)piperazin-1-yl]-1H-indazole;4-(4-benzylsulfonylpiperazin-1-yl)-1H-indazole;1-[4-(1H-indazol-4-yl)piperazin-1-yl]ethanone;1-[4-(1H-indazol-4-yl)piperidin-1-yl]ethanone;4-(1-methylsulfonylpiperidin-4-yl)-1H-indazole
CID 157732345
4-[4-(benzenesulfonyl)piperazin-1-yl]-1H-indazole;4-(4-benzylsulfonylpiperazin-1-yl)-1H-indazole;1-[4-(1H-indazol-4-yl)piperazin-1-yl]ethanone;4-(1-methylsulfonylpiperidin-4-yl)-1H-indazole
CID 158009125
1-[[1-(benzenesulfonyl)piperidin-4-yl]methyl]-5-(1H-pyrazol-4-yl)indazole;1-[(1-benzylsulfonylpiperidin-4-yl)methyl]-5-(1H-pyrazol-4-yl)indazole;1-[(1-cyclohexylsulfonylpiperidin-4-yl)methyl]-5-(1H-pyrazol-4-yl)indazole;1-[(1-methylsulfonylpiperidin-4-yl)methyl]-5-(1H-pyrazol-4-yl)indazole;1-[[1-(2-phenylethylsulfonyl)piperidin-4-yl]methyl]-5-(1H-pyrazol-4-yl)indazole
CID 158261600
1-[[(3R,5S)-1-(2,3-difluorophenyl)sulfonyl-5-methylpyrrolidin-3-yl]methyl]-5-(1H-pyrazol-4-yl)indazole;1-[[(3R,5S)-1-(4-fluorophenyl)sulfonyl-5-methylpyrrolidin-3-yl]methyl]-5-(1H-pyrazol-4-yl)indazole;1-[[1-(2-fluorophenyl)sulfonylpiperidin-4-yl]methyl]-5-(1H-pyrazol-4-yl)indazole;1-[[1-(3-fluorophenyl)sulfonylpiperidin-4-yl]methyl]-5-(1H-pyrazol-4-yl)indazole
CID 158901723
4-(4-benzylsulfonylpiperazin-1-yl)-1H-indazole;1-[4-(1H-indazol-4-yl)piperazin-1-yl]ethanone;4-(4-methylsulfonylpiperazin-1-yl)-1H-indazole;4-(1-methylsulfonylpiperidin-4-yl)-1H-indazole
CID 159060540
4-(1H-indazol-4-yl)-N,N-dimethylpiperazine-1-sulfonamide;4-(1H-indazol-4-yl)piperazine-1-sulfonamide;4-[4-(2-methoxyethylsulfonyl)piperazin-1-yl]-1H-indazole;4-(4-propan-2-ylsulfonylpiperazin-1-yl)-1H-indazole
CID 159242345

Frequently Asked Questions

What is the IUPAC name of 4-[4-(benzenesulfonyl)piperazin-1-yl]-1H-indazole;4-(4-cyclopentylsulfonylpiperazin-1-yl)-1H-indazole;4-(4-propylsulfonylpiperazin-1-yl)-1H-indazole;4-[4-(2,2,2-trifluoroethylsulfonyl)piperazin-1-yl]-1H-indazole?
The IUPAC name of 4-[4-(benzenesulfonyl)piperazin-1-yl]-1H-indazole;4-(4-cyclopentylsulfonylpiperazin-1-yl)-1H-indazole;4-(4-propylsulfonylpiperazin-1-yl)-1H-indazole;4-[4-(2,2,2-trifluoroethylsulfonyl)piperazin-1-yl]-1H-indazole (CID 162152140) is 4-[4-(benzenesulfonyl)piperazin-1-yl]-1H-indazole;4-(4-cyclopentylsulfonylpiperazin-1-yl)-1H-indazole;4-(4-propylsulfonylpiperazin-1-yl)-1H-indazole;4-[4-(2,2,2-trifluoroethylsulfonyl)piperazin-1-yl]-1H-indazole.
What is the SMILES notation for 4-[4-(benzenesulfonyl)piperazin-1-yl]-1H-indazole;4-(4-cyclopentylsulfonylpiperazin-1-yl)-1H-indazole;4-(4-propylsulfonylpiperazin-1-yl)-1H-indazole;4-[4-(2,2,2-trifluoroethylsulfonyl)piperazin-1-yl]-1H-indazole?
The canonical SMILES for 4-[4-(benzenesulfonyl)piperazin-1-yl]-1H-indazole;4-(4-cyclopentylsulfonylpiperazin-1-yl)-1H-indazole;4-(4-propylsulfonylpiperazin-1-yl)-1H-indazole;4-[4-(2,2,2-trifluoroethylsulfonyl)piperazin-1-yl]-1H-indazole is CCCS(=O)(=O)N1CCN(c2cccc3[nH]ncc23)CC1.O=S(=O)(C1CCCC1)N1CCN(c2cccc3[nH]ncc23)CC1.O=S(=O)(CC(F)(F)F)N1CCN(c2cccc3[nH]ncc23)CC1.O=S(=O)(c1ccccc1)N1CCN(c2cccc3[nH]ncc23)CC1.
What is the InChIKey of 4-[4-(benzenesulfonyl)piperazin-1-yl]-1H-indazole;4-(4-cyclopentylsulfonylpiperazin-1-yl)-1H-indazole;4-(4-propylsulfonylpiperazin-1-yl)-1H-indazole;4-[4-(2,2,2-trifluoroethylsulfonyl)piperazin-1-yl]-1H-indazole?
The InChIKey is ZLIXEBCAIBRTBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N4O2S.C16H22N4O2S.C14H20N4O2S.C13H15F3N4O2S/c22-24(23,14-5-2-1-3-6-14)21-11-9-20(10-12-21)17-8-4-7-16-15(17)13-18-19-16;21-23(22,13-4-1-2-5-13)20-10-8-19(9-11-20)16-7-3-6-15-14(16)12-17-18-15;1-2-10-21(19,20)18-8-6-17(7-9-18)14-5-3-4-13-12(14)11-15-16-13;14-13(15,16)9-23(21,22)20-6-4-19(5-7-20)12-3-1-2-11-10(12)8-17-18-11/h1-8,13H,9-12H2,(H,18,19);3,6-7,12-13H,1-2,4-5,8-11H2,(H,17,18);3-5,11H,2,6-10H2,1H3,(H,15,16);1-3,8H,4-7,9H2,(H,17,18).
What are the key properties of 4-[4-(benzenesulfonyl)piperazin-1-yl]-1H-indazole;4-(4-cyclopentylsulfonylpiperazin-1-yl)-1H-indazole;4-(4-propylsulfonylpiperazin-1-yl)-1H-indazole;4-[4-(2,2,2-trifluoroethylsulfonyl)piperazin-1-yl]-1H-indazole?
4-[4-(benzenesulfonyl)piperazin-1-yl]-1H-indazole;4-(4-cyclopentylsulfonylpiperazin-1-yl)-1H-indazole;4-(4-propylsulfonylpiperazin-1-yl)-1H-indazole;4-[4-(2,2,2-trifluoroethylsulfonyl)piperazin-1-yl]-1H-indazole has a molecular weight of 1333.63 g/mol, XLogP of 7.03, 13 rotatable bonds, 4 hydrogen bond donors, and 16 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-(benzenesulfonyl)piperazin-1-yl]-1H-indazole;4-(4-cyclopentylsulfonylpiperazin-1-yl)-1H-indazole;4-(4-propylsulfonylpiperazin-1-yl)-1H-indazole;4-[4-(2,2,2-trifluoroethylsulfonyl)piperazin-1-yl]-1H-indazole is sourced from PubChem (CID 162152140), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).