N-[4-(6-chloro-1H-indazol-4-yl)phenyl]methanesulfonamide;1-[4-(6-cyclopentyl-1H-indazol-4-yl)piperidin-1-yl]ethanone;6-cyclopentyl-4-(1-methylsulfonylpiperidin-4-yl)-1H-indazole;4-(3,3-dimethyl-4-methylsulfonylpiperazin-1-yl)-6-(trifluoromethoxy)-1H-indazole;4-(4-methylsulfonylpiperazin-1-yl)-6-(trifluoromethoxy)-1H-indazole

C79H96ClF6N17O11S4 — CID 160914332

IUPACN-[4-(6-chloro-1H-indazol-4-yl)phenyl]methanesulfonamide;1-[4-(6-cyclopentyl-1H-indazol-4-yl)piperidin-1-yl]ethanone;6-cyclopentyl-4-(1-methylsulfonylpiperidin-4-yl)-1H-indazole;4-(3,3-dimethyl-4-methylsulfonylpiperazin-1-yl)-6-(trifluoromethoxy)-1H-indazole;4-(4-methylsulfonylpiperazin-1-yl)-6-(trifluoromethoxy)-1H-indazole
SMILESCC(=O)N1CCC(c2cc(C3CCCC3)cc3[nH]ncc23)CC1.CC1(C)CN(c2cc(OC(F)(F)F)cc3[nH]ncc23)CCN1S(C)(=O)=O.CS(=O)(=O)N1CCC(c2cc(C3CCCC3)cc3[nH]ncc23)CC1.CS(=O)(=O)N1CCN(c2cc(OC(F)(F)F)cc3[nH]ncc23)CC1.CS(=O)(=O)Nc1ccc(-c2cc(Cl)cc3[nH]ncc23)cc1
InChIInChI=1S/C19H25N3O.C18H25N3O2S.C15H19F3N4O3S.C14H12ClN3O2S.C13H15F3N4O3S/c1-13(23)22-8-6-15(7-9-22)17-10-16(14-4-2-3-5-14)11-19-18(17)12-20-21-19;1-24(22,23)21-8-6-14(7-9-21)16-10-15(13-4-2-3-5-13)11-18-17(16)12-19-20-18;1-14(2)9-21(4-5-22(14)26(3,23)24)13-7-10(25-15(16,17)18)6-12-11(13)8-19-20-12;1-21(19,20)18-11-4-2-9(3-5-11)12-6-10(15)7-14-13(12)8-16-17-14;1-24(21,22)20-4-2-19(3-5-20)12-7-9(23-13(14,15)16)6-11-10(12)8-17-18-11/h10-12,14-15H,2-9H2,1H3,(H,20,21);10-14H,2-9H2,1H3,(H,19,20);6-8H,4-5,9H2,1-3H3,(H,19,20);2-8,18H,1H3,(H,16,17);6-8H,2-5H2,1H3,(H,17,18)
InChIKeySREZOVAJDHXSGS-UHFFFAOYSA-N
MW1737.45 g/mol
LogP14.43
Rot. Bonds14

About N-[4-(6-chloro-1H-indazol-4-yl)phenyl]methanesulfonamide;1-[4-(6-cyclopentyl-1H-indazol-4-yl)piperidin-1-yl]ethanone;6-cyclopentyl-4-(1-methylsulfonylpiperidin-4-yl)-1H-indazole;4-(3,3-dimethyl-4-methylsulfonylpiperazin-1-yl)-6-(trifluoromethoxy)-1H-indazole;4-(4-methylsulfonylpiperazin-1-yl)-6-(trifluoromethoxy)-1H-indazole

N-[4-(6-chloro-1H-indazol-4-yl)phenyl]methanesulfonamide;1-[4-(6-cyclopentyl-1H-indazol-4-yl)piperidin-1-yl]ethanone;6-cyclopentyl-4-(1-methylsulfonylpiperidin-4-yl)-1H-indazole;4-(3,3-dimethyl-4-methylsulfonylpiperazin-1-yl)-6-(trifluoromethoxy)-1H-indazole;4-(4-methylsulfonylpiperazin-1-yl)-6-(trifluoromethoxy)-1H-indazole (PubChem CID 160914332) has the molecular formula C79H96ClF6N17O11S4 and a molecular weight of 1737.45 g/mol. Its IUPAC name is N-[4-(6-chloro-1H-indazol-4-yl)phenyl]methanesulfonamide;1-[4-(6-cyclopentyl-1H-indazol-4-yl)piperidin-1-yl]ethanone;6-cyclopentyl-4-(1-methylsulfonylpiperidin-4-yl)-1H-indazole;4-(3,3-dimethyl-4-methylsulfonylpiperazin-1-yl)-6-(trifluoromethoxy)-1H-indazole;4-(4-methylsulfonylpiperazin-1-yl)-6-(trifluoromethoxy)-1H-indazole.

Molecular Properties

Compound NameN-[4-(6-chloro-1H-indazol-4-yl)phenyl]methanesulfonamide;1-[4-(6-cyclopentyl-1H-indazol-4-yl)piperidin-1-yl]ethanone;6-cyclopentyl-4-(1-methylsulfonylpiperidin-4-yl)-1H-indazole;4-(3,3-dimethyl-4-methylsulfonylpiperazin-1-yl)-6-(trifluoromethoxy)-1H-indazole;4-(4-methylsulfonylpiperazin-1-yl)-6-(trifluoromethoxy)-1H-indazole
PubChem CID160914332
Molecular FormulaC79H96ClF6N17O11S4
Molecular Weight1737.45 g/mol
Exact Mass1735.60
IUPAC NameN-[4-(6-chloro-1H-indazol-4-yl)phenyl]methanesulfonamide;1-[4-(6-cyclopentyl-1H-indazol-4-yl)piperidin-1-yl]ethanone;6-cyclopentyl-4-(1-methylsulfonylpiperidin-4-yl)-1H-indazole;4-(3,3-dimethyl-4-methylsulfonylpiperazin-1-yl)-6-(trifluoromethoxy)-1H-indazole;4-(4-methylsulfonylpiperazin-1-yl)-6-(trifluoromethoxy)-1H-indazole
SMILESCC(=O)N1CCC(c2cc(C3CCCC3)cc3[nH]ncc23)CC1.CC1(C)CN(c2cc(OC(F)(F)F)cc3[nH]ncc23)CCN1S(C)(=O)=O.CS(=O)(=O)N1CCC(c2cc(C3CCCC3)cc3[nH]ncc23)CC1.CS(=O)(=O)N1CCN(c2cc(OC(F)(F)F)cc3[nH]ncc23)CC1.CS(=O)(=O)Nc1ccc(-c2cc(Cl)cc3[nH]ncc23)cc1
InChIInChI=1S/C19H25N3O.C18H25N3O2S.C15H19F3N4O3S.C14H12ClN3O2S.C13H15F3N4O3S/c1-13(23)22-8-6-15(7-9-22)17-10-16(14-4-2-3-5-14)11-19-18(17)12-20-21-19;1-24(22,23)21-8-6-14(7-9-21)16-10-15(13-4-2-3-5-13)11-18-17(16)12-19-20-18;1-14(2)9-21(4-5-22(14)26(3,23)24)13-7-10(25-15(16,17)18)6-12-11(13)8-19-20-12;1-21(19,20)18-11-4-2-9(3-5-11)12-6-10(15)7-14-13(12)8-16-17-14;1-24(21,22)20-4-2-19(3-5-20)12-7-9(23-13(14,15)16)6-11-10(12)8-17-18-11/h10-12,14-15H,2-9H2,1H3,(H,20,21);10-14H,2-9H2,1H3,(H,19,20);6-8H,4-5,9H2,1-3H3,(H,19,20);2-8,18H,1H3,(H,16,17);6-8H,2-5H2,1H3,(H,17,18)
InChIKeySREZOVAJDHXSGS-UHFFFAOYSA-N
XLogP14.43
TPSA346.96 Ų
H-Bond Donors6
H-Bond Acceptors18
Rotatable Bonds14
Heavy Atoms118
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001737.45
LogP ≤ 514.43
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1018

Analyze N-[4-(6-chloro-1H-indazol-4-yl)phenyl]methanesulfonamide;1-[4-(6-cyclopentyl-1H-indazol-4-yl)piperidin-1-yl]ethanone;6-cyclopentyl-4-(1-methylsulfonylpiperidin-4-yl)-1H-indazole;4-(3,3-dimethyl-4-methylsulfonylpiperazin-1-yl)-6-(trifluoromethoxy)-1H-indazole;4-(4-methylsulfonylpiperazin-1-yl)-6-(trifluoromethoxy)-1H-indazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-[4-(6-chloro-1H-indazol-4-yl)phenyl]methanesulfonamide;1-[4-(6-cyclopentyl-1H-indazol-4-yl)piperidin-1-yl]ethanone;6-cyclopentyl-4-(1-methylsulfonylpiperidin-4-yl)-1H-indazole;4-(3,3-dimethyl-4-methylsulfonylpiperazin-1-yl)-6-(trifluoromethoxy)-1H-indazole;4-(4-methylsulfonylpiperazin-1-yl)-6-(trifluoromethoxy)-1H-indazole?
The IUPAC name of N-[4-(6-chloro-1H-indazol-4-yl)phenyl]methanesulfonamide;1-[4-(6-cyclopentyl-1H-indazol-4-yl)piperidin-1-yl]ethanone;6-cyclopentyl-4-(1-methylsulfonylpiperidin-4-yl)-1H-indazole;4-(3,3-dimethyl-4-methylsulfonylpiperazin-1-yl)-6-(trifluoromethoxy)-1H-indazole;4-(4-methylsulfonylpiperazin-1-yl)-6-(trifluoromethoxy)-1H-indazole (CID 160914332) is N-[4-(6-chloro-1H-indazol-4-yl)phenyl]methanesulfonamide;1-[4-(6-cyclopentyl-1H-indazol-4-yl)piperidin-1-yl]ethanone;6-cyclopentyl-4-(1-methylsulfonylpiperidin-4-yl)-1H-indazole;4-(3,3-dimethyl-4-methylsulfonylpiperazin-1-yl)-6-(trifluoromethoxy)-1H-indazole;4-(4-methylsulfonylpiperazin-1-yl)-6-(trifluoromethoxy)-1H-indazole.
What is the SMILES notation for N-[4-(6-chloro-1H-indazol-4-yl)phenyl]methanesulfonamide;1-[4-(6-cyclopentyl-1H-indazol-4-yl)piperidin-1-yl]ethanone;6-cyclopentyl-4-(1-methylsulfonylpiperidin-4-yl)-1H-indazole;4-(3,3-dimethyl-4-methylsulfonylpiperazin-1-yl)-6-(trifluoromethoxy)-1H-indazole;4-(4-methylsulfonylpiperazin-1-yl)-6-(trifluoromethoxy)-1H-indazole?
The canonical SMILES for N-[4-(6-chloro-1H-indazol-4-yl)phenyl]methanesulfonamide;1-[4-(6-cyclopentyl-1H-indazol-4-yl)piperidin-1-yl]ethanone;6-cyclopentyl-4-(1-methylsulfonylpiperidin-4-yl)-1H-indazole;4-(3,3-dimethyl-4-methylsulfonylpiperazin-1-yl)-6-(trifluoromethoxy)-1H-indazole;4-(4-methylsulfonylpiperazin-1-yl)-6-(trifluoromethoxy)-1H-indazole is CC(=O)N1CCC(c2cc(C3CCCC3)cc3[nH]ncc23)CC1.CC1(C)CN(c2cc(OC(F)(F)F)cc3[nH]ncc23)CCN1S(C)(=O)=O.CS(=O)(=O)N1CCC(c2cc(C3CCCC3)cc3[nH]ncc23)CC1.CS(=O)(=O)N1CCN(c2cc(OC(F)(F)F)cc3[nH]ncc23)CC1.CS(=O)(=O)Nc1ccc(-c2cc(Cl)cc3[nH]ncc23)cc1.
What is the InChIKey of N-[4-(6-chloro-1H-indazol-4-yl)phenyl]methanesulfonamide;1-[4-(6-cyclopentyl-1H-indazol-4-yl)piperidin-1-yl]ethanone;6-cyclopentyl-4-(1-methylsulfonylpiperidin-4-yl)-1H-indazole;4-(3,3-dimethyl-4-methylsulfonylpiperazin-1-yl)-6-(trifluoromethoxy)-1H-indazole;4-(4-methylsulfonylpiperazin-1-yl)-6-(trifluoromethoxy)-1H-indazole?
The InChIKey is SREZOVAJDHXSGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N3O.C18H25N3O2S.C15H19F3N4O3S.C14H12ClN3O2S.C13H15F3N4O3S/c1-13(23)22-8-6-15(7-9-22)17-10-16(14-4-2-3-5-14)11-19-18(17)12-20-21-19;1-24(22,23)21-8-6-14(7-9-21)16-10-15(13-4-2-3-5-13)11-18-17(16)12-19-20-18;1-14(2)9-21(4-5-22(14)26(3,23)24)13-7-10(25-15(16,17)18)6-12-11(13)8-19-20-12;1-21(19,20)18-11-4-2-9(3-5-11)12-6-10(15)7-14-13(12)8-16-17-14;1-24(21,22)20-4-2-19(3-5-20)12-7-9(23-13(14,15)16)6-11-10(12)8-17-18-11/h10-12,14-15H,2-9H2,1H3,(H,20,21);10-14H,2-9H2,1H3,(H,19,20);6-8H,4-5,9H2,1-3H3,(H,19,20);2-8,18H,1H3,(H,16,17);6-8H,2-5H2,1H3,(H,17,18).
What are the key properties of N-[4-(6-chloro-1H-indazol-4-yl)phenyl]methanesulfonamide;1-[4-(6-cyclopentyl-1H-indazol-4-yl)piperidin-1-yl]ethanone;6-cyclopentyl-4-(1-methylsulfonylpiperidin-4-yl)-1H-indazole;4-(3,3-dimethyl-4-methylsulfonylpiperazin-1-yl)-6-(trifluoromethoxy)-1H-indazole;4-(4-methylsulfonylpiperazin-1-yl)-6-(trifluoromethoxy)-1H-indazole?
N-[4-(6-chloro-1H-indazol-4-yl)phenyl]methanesulfonamide;1-[4-(6-cyclopentyl-1H-indazol-4-yl)piperidin-1-yl]ethanone;6-cyclopentyl-4-(1-methylsulfonylpiperidin-4-yl)-1H-indazole;4-(3,3-dimethyl-4-methylsulfonylpiperazin-1-yl)-6-(trifluoromethoxy)-1H-indazole;4-(4-methylsulfonylpiperazin-1-yl)-6-(trifluoromethoxy)-1H-indazole has a molecular weight of 1737.45 g/mol, XLogP of 14.43, 14 rotatable bonds, 6 hydrogen bond donors, and 18 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(6-chloro-1H-indazol-4-yl)phenyl]methanesulfonamide;1-[4-(6-cyclopentyl-1H-indazol-4-yl)piperidin-1-yl]ethanone;6-cyclopentyl-4-(1-methylsulfonylpiperidin-4-yl)-1H-indazole;4-(3,3-dimethyl-4-methylsulfonylpiperazin-1-yl)-6-(trifluoromethoxy)-1H-indazole;4-(4-methylsulfonylpiperazin-1-yl)-6-(trifluoromethoxy)-1H-indazole is sourced from PubChem (CID 160914332), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).