1-[4-[(6-chloro-1H-indazol-4-yl)oxy]piperidin-1-yl]ethanone;6-chloro-1-(2-methoxyethyl)-4-(1-methylsulfonylpiperidin-4-yl)oxyindazole;2-[6-chloro-4-(1-methylsulfonylpiperidin-4-yl)oxyindazol-1-yl]ethanol;6-chloro-4-(3,3,4-trimethylpiperazin-1-yl)-1H-indazole;4-(3,3-dimethyl-4-methylsulfonylpiperazin-1-yl)-6-ethyl-1H-indazole

C75H101Cl4N17O12S3 — CID 161463015

About 1-[4-[(6-chloro-1H-indazol-4-yl)oxy]piperidin-1-yl]ethanone;6-chloro-1-(2-methoxyethyl)-4-(1-methylsulfonylpiperidin-4-yl)oxyindazole;2-[6-chloro-4-(1-methylsulfonylpiperidin-4-yl)oxyindazol-1-yl]ethanol;6-chloro-4-(3,3,4-trimethylpiperazin-1-yl)-1H-indazole;4-(3,3-dimethyl-4-methylsulfonylpiperazin-1-yl)-6-ethyl-1H-indazole

1-[4-[(6-chloro-1H-indazol-4-yl)oxy]piperidin-1-yl]ethanone;6-chloro-1-(2-methoxyethyl)-4-(1-methylsulfonylpiperidin-4-yl)oxyindazole;2-[6-chloro-4-(1-methylsulfonylpiperidin-4-yl)oxyindazol-1-yl]ethanol;6-chloro-4-(3,3,4-trimethylpiperazin-1-yl)-1H-indazole;4-(3,3-dimethyl-4-methylsulfonylpiperazin-1-yl)-6-ethyl-1H-indazole (PubChem CID 161463015) has the molecular formula C75H101Cl4N17O12S3 and a molecular weight of 1670.75 g/mol. Its IUPAC name is 1-[4-[(6-chloro-1H-indazol-4-yl)oxy]piperidin-1-yl]ethanone;6-chloro-1-(2-methoxyethyl)-4-(1-methylsulfonylpiperidin-4-yl)oxyindazole;2-[6-chloro-4-(1-methylsulfonylpiperidin-4-yl)oxyindazol-1-yl]ethanol;6-chloro-4-(3,3,4-trimethylpiperazin-1-yl)-1H-indazole;4-(3,3-dimethyl-4-methylsulfonylpiperazin-1-yl)-6-ethyl-1H-indazole.

Molecular Properties

• Compound Name: 1-[4-[(6-chloro-1H-indazol-4-yl)oxy]piperidin-1-yl]ethanone;6-chloro-1-(2-methoxyethyl)-4-(1-methylsulfonylpiperidin-4-yl)oxyindazole;2-[6-chloro-4-(1-methylsulfonylpiperidin-4-yl)oxyindazol-1-yl]ethanol;6-chloro-4-(3,3,4-trimethylpiperazin-1-yl)-1H-indazole;4-(3,3-dimethyl-4-methylsulfonylpiperazin-1-yl)-6-ethyl-1H-indazole
• PubChem CID: 161463015
• Molecular Formula: C75H101Cl4N17O12S3
• Molecular Weight: 1670.75 g/mol
• Exact Mass: 1667.57
• IUPAC Name: 1-[4-[(6-chloro-1H-indazol-4-yl)oxy]piperidin-1-yl]ethanone;6-chloro-1-(2-methoxyethyl)-4-(1-methylsulfonylpiperidin-4-yl)oxyindazole;2-[6-chloro-4-(1-methylsulfonylpiperidin-4-yl)oxyindazol-1-yl]ethanol;6-chloro-4-(3,3,4-trimethylpiperazin-1-yl)-1H-indazole;4-(3,3-dimethyl-4-methylsulfonylpiperazin-1-yl)-6-ethyl-1H-indazole
• SMILES: CC(=O)N1CCC(Oc2cc(Cl)cc3[nH]ncc23)CC1.CCc1cc(N2CCN(S(C)(=O)=O)C(C)(C)C2)c2cn[nH]c2c1.CN1CCN(c2cc(Cl)cc3[nH]ncc23)CC1(C)C.COCCn1ncc2c(OC3CCN(S(C)(=O)=O)CC3)cc(Cl)cc21.CS(=O)(=O)N1CCC(Oc2cc(Cl)cc3c2cnn3CCO)CC1
• InChI: InChI=1S/C16H22ClN3O4S.C16H24N4O2S.C15H20ClN3O4S.C14H19ClN4.C14H16ClN3O2/c1-23-8-7-20-15-9-12(17)10-16(14(15)11-18-20)24-13-3-5-19(6-4-13)25(2,21)22;1-5-12-8-14-13(10-17-18-14)15(9-12)19-6-7-20(23(4,21)22)16(2,3)11-19;1-24(21,22)18-4-2-12(3-5-18)23-15-9-11(16)8-14-13(15)10-17-19(14)6-7-20;1-14(2)9-19(5-4-18(14)3)13-7-10(15)6-12-11(13)8-16-17-12;1-9(19)18-4-2-11(3-5-18)20-14-7-10(15)6-13-12(14)8-16-17-13/h9-11,13H,3-8H2,1-2H3;8-10H,5-7,11H2,1-4H3,(H,17,18);8-10,12,20H,2-7H2,1H3;6-8H,4-5,9H2,1-3H3,(H,16,17);6-8,11H,2-5H2,1H3,(H,16,17)
• InChIKey: WCBJFPLFSLDOFG-UHFFFAOYSA-N
• XLogP: 10.96
• TPSA: 321.00 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 22
• Rotatable Bonds: 17
• Heavy Atoms: 111
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1670.75
LogP ≤ 5	10.96
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	22

Frequently Asked Questions

What is the IUPAC name of 1-[4-[(6-chloro-1H-indazol-4-yl)oxy]piperidin-1-yl]ethanone;6-chloro-1-(2-methoxyethyl)-4-(1-methylsulfonylpiperidin-4-yl)oxyindazole;2-[6-chloro-4-(1-methylsulfonylpiperidin-4-yl)oxyindazol-1-yl]ethanol;6-chloro-4-(3,3,4-trimethylpiperazin-1-yl)-1H-indazole;4-(3,3-dimethyl-4-methylsulfonylpiperazin-1-yl)-6-ethyl-1H-indazole?

The IUPAC name of 1-[4-[(6-chloro-1H-indazol-4-yl)oxy]piperidin-1-yl]ethanone;6-chloro-1-(2-methoxyethyl)-4-(1-methylsulfonylpiperidin-4-yl)oxyindazole;2-[6-chloro-4-(1-methylsulfonylpiperidin-4-yl)oxyindazol-1-yl]ethanol;6-chloro-4-(3,3,4-trimethylpiperazin-1-yl)-1H-indazole;4-(3,3-dimethyl-4-methylsulfonylpiperazin-1-yl)-6-ethyl-1H-indazole (CID 161463015) is 1-[4-[(6-chloro-1H-indazol-4-yl)oxy]piperidin-1-yl]ethanone;6-chloro-1-(2-methoxyethyl)-4-(1-methylsulfonylpiperidin-4-yl)oxyindazole;2-[6-chloro-4-(1-methylsulfonylpiperidin-4-yl)oxyindazol-1-yl]ethanol;6-chloro-4-(3,3,4-trimethylpiperazin-1-yl)-1H-indazole;4-(3,3-dimethyl-4-methylsulfonylpiperazin-1-yl)-6-ethyl-1H-indazole.

What is the SMILES notation for 1-[4-[(6-chloro-1H-indazol-4-yl)oxy]piperidin-1-yl]ethanone;6-chloro-1-(2-methoxyethyl)-4-(1-methylsulfonylpiperidin-4-yl)oxyindazole;2-[6-chloro-4-(1-methylsulfonylpiperidin-4-yl)oxyindazol-1-yl]ethanol;6-chloro-4-(3,3,4-trimethylpiperazin-1-yl)-1H-indazole;4-(3,3-dimethyl-4-methylsulfonylpiperazin-1-yl)-6-ethyl-1H-indazole?

The canonical SMILES for 1-[4-[(6-chloro-1H-indazol-4-yl)oxy]piperidin-1-yl]ethanone;6-chloro-1-(2-methoxyethyl)-4-(1-methylsulfonylpiperidin-4-yl)oxyindazole;2-[6-chloro-4-(1-methylsulfonylpiperidin-4-yl)oxyindazol-1-yl]ethanol;6-chloro-4-(3,3,4-trimethylpiperazin-1-yl)-1H-indazole;4-(3,3-dimethyl-4-methylsulfonylpiperazin-1-yl)-6-ethyl-1H-indazole is CC(=O)N1CCC(Oc2cc(Cl)cc3[nH]ncc23)CC1.CCc1cc(N2CCN(S(C)(=O)=O)C(C)(C)C2)c2cn[nH]c2c1.CN1CCN(c2cc(Cl)cc3[nH]ncc23)CC1(C)C.COCCn1ncc2c(OC3CCN(S(C)(=O)=O)CC3)cc(Cl)cc21.CS(=O)(=O)N1CCC(Oc2cc(Cl)cc3c2cnn3CCO)CC1.

What is the InChIKey of 1-[4-[(6-chloro-1H-indazol-4-yl)oxy]piperidin-1-yl]ethanone;6-chloro-1-(2-methoxyethyl)-4-(1-methylsulfonylpiperidin-4-yl)oxyindazole;2-[6-chloro-4-(1-methylsulfonylpiperidin-4-yl)oxyindazol-1-yl]ethanol;6-chloro-4-(3,3,4-trimethylpiperazin-1-yl)-1H-indazole;4-(3,3-dimethyl-4-methylsulfonylpiperazin-1-yl)-6-ethyl-1H-indazole?

The InChIKey is WCBJFPLFSLDOFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22ClN3O4S.C16H24N4O2S.C15H20ClN3O4S.C14H19ClN4.C14H16ClN3O2/c1-23-8-7-20-15-9-12(17)10-16(14(15)11-18-20)24-13-3-5-19(6-4-13)25(2,21)22;1-5-12-8-14-13(10-17-18-14)15(9-12)19-6-7-20(23(4,21)22)16(2,3)11-19;1-24(21,22)18-4-2-12(3-5-18)23-15-9-11(16)8-14-13(15)10-17-19(14)6-7-20;1-14(2)9-19(5-4-18(14)3)13-7-10(15)6-12-11(13)8-16-17-12;1-9(19)18-4-2-11(3-5-18)20-14-7-10(15)6-13-12(14)8-16-17-13/h9-11,13H,3-8H2,1-2H3;8-10H,5-7,11H2,1-4H3,(H,17,18);8-10,12,20H,2-7H2,1H3;6-8H,4-5,9H2,1-3H3,(H,16,17);6-8,11H,2-5H2,1H3,(H,16,17).

What are the key properties of 1-[4-[(6-chloro-1H-indazol-4-yl)oxy]piperidin-1-yl]ethanone;6-chloro-1-(2-methoxyethyl)-4-(1-methylsulfonylpiperidin-4-yl)oxyindazole;2-[6-chloro-4-(1-methylsulfonylpiperidin-4-yl)oxyindazol-1-yl]ethanol;6-chloro-4-(3,3,4-trimethylpiperazin-1-yl)-1H-indazole;4-(3,3-dimethyl-4-methylsulfonylpiperazin-1-yl)-6-ethyl-1H-indazole?

1-[4-[(6-chloro-1H-indazol-4-yl)oxy]piperidin-1-yl]ethanone;6-chloro-1-(2-methoxyethyl)-4-(1-methylsulfonylpiperidin-4-yl)oxyindazole;2-[6-chloro-4-(1-methylsulfonylpiperidin-4-yl)oxyindazol-1-yl]ethanol;6-chloro-4-(3,3,4-trimethylpiperazin-1-yl)-1H-indazole;4-(3,3-dimethyl-4-methylsulfonylpiperazin-1-yl)-6-ethyl-1H-indazole has a molecular weight of 1670.75 g/mol, XLogP of 10.96, 17 rotatable bonds, 4 hydrogen bond donors, and 22 hydrogen bond acceptors.

Where does this data come from?

All data for 1-[4-[(6-chloro-1H-indazol-4-yl)oxy]piperidin-1-yl]ethanone;6-chloro-1-(2-methoxyethyl)-4-(1-methylsulfonylpiperidin-4-yl)oxyindazole;2-[6-chloro-4-(1-methylsulfonylpiperidin-4-yl)oxyindazol-1-yl]ethanol;6-chloro-4-(3,3,4-trimethylpiperazin-1-yl)-1H-indazole;4-(3,3-dimethyl-4-methylsulfonylpiperazin-1-yl)-6-ethyl-1H-indazole is sourced from PubChem (CID 161463015), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).