3-(2,3-dihydro-1-benzofuran-5-yl)-5-[5-(2-methylpropyl)-1H-1,2,4-triazol-3-yl]-1H-indazole;3-(4-fluoro-3-methylphenyl)-5-[5-(2-methylpropyl)-1H-1,2,4-triazol-3-yl]-1H-indazole;3-(4-methoxy-3-methylphenyl)-5-[5-(2-methylpropyl)-1H-1,2,4-triazol-3-yl]-1H-indazole;3-(6-methoxy-3-pyridinyl)-5-[5-(2-methylpropyl)-1H-1,2,4-triazol-3-yl]-1H-indazole

C81H84FN21O3 — CID 159410724

About 3-(2,3-dihydro-1-benzofuran-5-yl)-5-[5-(2-methylpropyl)-1H-1,2,4-triazol-3-yl]-1H-indazole;3-(4-fluoro-3-methylphenyl)-5-[5-(2-methylpropyl)-1H-1,2,4-triazol-3-yl]-1H-indazole;3-(4-methoxy-3-methylphenyl)-5-[5-(2-methylpropyl)-1H-1,2,4-triazol-3-yl]-1H-indazole;3-(6-methoxy-3-pyridinyl)-5-[5-(2-methylpropyl)-1H-1,2,4-triazol-3-yl]-1H-indazole

3-(2,3-dihydro-1-benzofuran-5-yl)-5-[5-(2-methylpropyl)-1H-1,2,4-triazol-3-yl]-1H-indazole;3-(4-fluoro-3-methylphenyl)-5-[5-(2-methylpropyl)-1H-1,2,4-triazol-3-yl]-1H-indazole;3-(4-methoxy-3-methylphenyl)-5-[5-(2-methylpropyl)-1H-1,2,4-triazol-3-yl]-1H-indazole;3-(6-methoxy-3-pyridinyl)-5-[5-(2-methylpropyl)-1H-1,2,4-triazol-3-yl]-1H-indazole (PubChem CID 159410724) has the molecular formula C81H84FN21O3 and a molecular weight of 1418.70 g/mol. Its IUPAC name is 3-(2,3-dihydro-1-benzofuran-5-yl)-5-[5-(2-methylpropyl)-1H-1,2,4-triazol-3-yl]-1H-indazole;3-(4-fluoro-3-methylphenyl)-5-[5-(2-methylpropyl)-1H-1,2,4-triazol-3-yl]-1H-indazole;3-(4-methoxy-3-methylphenyl)-5-[5-(2-methylpropyl)-1H-1,2,4-triazol-3-yl]-1H-indazole;3-(6-methoxy-3-pyridinyl)-5-[5-(2-methylpropyl)-1H-1,2,4-triazol-3-yl]-1H-indazole.

Molecular Properties

• Compound Name: 3-(2,3-dihydro-1-benzofuran-5-yl)-5-[5-(2-methylpropyl)-1H-1,2,4-triazol-3-yl]-1H-indazole;3-(4-fluoro-3-methylphenyl)-5-[5-(2-methylpropyl)-1H-1,2,4-triazol-3-yl]-1H-indazole;3-(4-methoxy-3-methylphenyl)-5-[5-(2-methylpropyl)-1H-1,2,4-triazol-3-yl]-1H-indazole;3-(6-methoxy-3-pyridinyl)-5-[5-(2-methylpropyl)-1H-1,2,4-triazol-3-yl]-1H-indazole
• PubChem CID: 159410724
• Molecular Formula: C81H84FN21O3
• Molecular Weight: 1418.70 g/mol
• Exact Mass: 1417.71
• IUPAC Name: 3-(2,3-dihydro-1-benzofuran-5-yl)-5-[5-(2-methylpropyl)-1H-1,2,4-triazol-3-yl]-1H-indazole;3-(4-fluoro-3-methylphenyl)-5-[5-(2-methylpropyl)-1H-1,2,4-triazol-3-yl]-1H-indazole;3-(4-methoxy-3-methylphenyl)-5-[5-(2-methylpropyl)-1H-1,2,4-triazol-3-yl]-1H-indazole;3-(6-methoxy-3-pyridinyl)-5-[5-(2-methylpropyl)-1H-1,2,4-triazol-3-yl]-1H-indazole
• SMILES: CC(C)Cc1nc(-c2ccc3[nH]nc(-c4ccc5c(c4)CCO5)c3c2)n[nH]1.COc1ccc(-c2n[nH]c3ccc(-c4n[nH]c(CC(C)C)n4)cc23)cc1C.COc1ccc(-c2n[nH]c3ccc(-c4n[nH]c(CC(C)C)n4)cc23)cn1.Cc1cc(-c2n[nH]c3ccc(-c4n[nH]c(CC(C)C)n4)cc23)ccc1F
• InChI: InChI=1S/C21H21N5O.C21H23N5O.C20H20FN5.C19H20N6O/c1-12(2)9-19-22-21(26-24-19)15-3-5-17-16(11-15)20(25-23-17)14-4-6-18-13(10-14)7-8-27-18;1-12(2)9-19-22-21(26-24-19)15-5-7-17-16(11-15)20(25-23-17)14-6-8-18(27-4)13(3)10-14;1-11(2)8-18-22-20(26-24-18)14-5-7-17-15(10-14)19(25-23-17)13-4-6-16(21)12(3)9-13;1-11(2)8-16-21-19(25-23-16)12-4-6-15-14(9-12)18(24-22-15)13-5-7-17(26-3)20-10-13/h3-6,10-12H,7-9H2,1-2H3,(H,23,25)(H,22,24,26);5-8,10-12H,9H2,1-4H3,(H,23,25)(H,22,24,26);4-7,9-11H,8H2,1-3H3,(H,23,25)(H,22,24,26);4-7,9-11H,8H2,1-3H3,(H,22,24)(H,21,23,25)
• InChIKey: LONSWGRXOOGAPE-UHFFFAOYSA-N
• XLogP: 16.96
• TPSA: 321.58 Ų
• H-Bond Donors: 8
• H-Bond Acceptors: 16
• Rotatable Bonds: 18
• Heavy Atoms: 106
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1418.70
LogP ≤ 5	16.96
H-Bond Donors ≤ 5	8
H-Bond Acceptors ≤ 10	16

Frequently Asked Questions

What is the IUPAC name of 3-(2,3-dihydro-1-benzofuran-5-yl)-5-[5-(2-methylpropyl)-1H-1,2,4-triazol-3-yl]-1H-indazole;3-(4-fluoro-3-methylphenyl)-5-[5-(2-methylpropyl)-1H-1,2,4-triazol-3-yl]-1H-indazole;3-(4-methoxy-3-methylphenyl)-5-[5-(2-methylpropyl)-1H-1,2,4-triazol-3-yl]-1H-indazole;3-(6-methoxy-3-pyridinyl)-5-[5-(2-methylpropyl)-1H-1,2,4-triazol-3-yl]-1H-indazole?

The IUPAC name of 3-(2,3-dihydro-1-benzofuran-5-yl)-5-[5-(2-methylpropyl)-1H-1,2,4-triazol-3-yl]-1H-indazole;3-(4-fluoro-3-methylphenyl)-5-[5-(2-methylpropyl)-1H-1,2,4-triazol-3-yl]-1H-indazole;3-(4-methoxy-3-methylphenyl)-5-[5-(2-methylpropyl)-1H-1,2,4-triazol-3-yl]-1H-indazole;3-(6-methoxy-3-pyridinyl)-5-[5-(2-methylpropyl)-1H-1,2,4-triazol-3-yl]-1H-indazole (CID 159410724) is 3-(2,3-dihydro-1-benzofuran-5-yl)-5-[5-(2-methylpropyl)-1H-1,2,4-triazol-3-yl]-1H-indazole;3-(4-fluoro-3-methylphenyl)-5-[5-(2-methylpropyl)-1H-1,2,4-triazol-3-yl]-1H-indazole;3-(4-methoxy-3-methylphenyl)-5-[5-(2-methylpropyl)-1H-1,2,4-triazol-3-yl]-1H-indazole;3-(6-methoxy-3-pyridinyl)-5-[5-(2-methylpropyl)-1H-1,2,4-triazol-3-yl]-1H-indazole.

What is the SMILES notation for 3-(2,3-dihydro-1-benzofuran-5-yl)-5-[5-(2-methylpropyl)-1H-1,2,4-triazol-3-yl]-1H-indazole;3-(4-fluoro-3-methylphenyl)-5-[5-(2-methylpropyl)-1H-1,2,4-triazol-3-yl]-1H-indazole;3-(4-methoxy-3-methylphenyl)-5-[5-(2-methylpropyl)-1H-1,2,4-triazol-3-yl]-1H-indazole;3-(6-methoxy-3-pyridinyl)-5-[5-(2-methylpropyl)-1H-1,2,4-triazol-3-yl]-1H-indazole?

The canonical SMILES for 3-(2,3-dihydro-1-benzofuran-5-yl)-5-[5-(2-methylpropyl)-1H-1,2,4-triazol-3-yl]-1H-indazole;3-(4-fluoro-3-methylphenyl)-5-[5-(2-methylpropyl)-1H-1,2,4-triazol-3-yl]-1H-indazole;3-(4-methoxy-3-methylphenyl)-5-[5-(2-methylpropyl)-1H-1,2,4-triazol-3-yl]-1H-indazole;3-(6-methoxy-3-pyridinyl)-5-[5-(2-methylpropyl)-1H-1,2,4-triazol-3-yl]-1H-indazole is CC(C)Cc1nc(-c2ccc3[nH]nc(-c4ccc5c(c4)CCO5)c3c2)n[nH]1.COc1ccc(-c2n[nH]c3ccc(-c4n[nH]c(CC(C)C)n4)cc23)cc1C.COc1ccc(-c2n[nH]c3ccc(-c4n[nH]c(CC(C)C)n4)cc23)cn1.Cc1cc(-c2n[nH]c3ccc(-c4n[nH]c(CC(C)C)n4)cc23)ccc1F.

What is the InChIKey of 3-(2,3-dihydro-1-benzofuran-5-yl)-5-[5-(2-methylpropyl)-1H-1,2,4-triazol-3-yl]-1H-indazole;3-(4-fluoro-3-methylphenyl)-5-[5-(2-methylpropyl)-1H-1,2,4-triazol-3-yl]-1H-indazole;3-(4-methoxy-3-methylphenyl)-5-[5-(2-methylpropyl)-1H-1,2,4-triazol-3-yl]-1H-indazole;3-(6-methoxy-3-pyridinyl)-5-[5-(2-methylpropyl)-1H-1,2,4-triazol-3-yl]-1H-indazole?

The InChIKey is LONSWGRXOOGAPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H21N5O.C21H23N5O.C20H20FN5.C19H20N6O/c1-12(2)9-19-22-21(26-24-19)15-3-5-17-16(11-15)20(25-23-17)14-4-6-18-13(10-14)7-8-27-18;1-12(2)9-19-22-21(26-24-19)15-5-7-17-16(11-15)20(25-23-17)14-6-8-18(27-4)13(3)10-14;1-11(2)8-18-22-20(26-24-18)14-5-7-17-15(10-14)19(25-23-17)13-4-6-16(21)12(3)9-13;1-11(2)8-16-21-19(25-23-16)12-4-6-15-14(9-12)18(24-22-15)13-5-7-17(26-3)20-10-13/h3-6,10-12H,7-9H2,1-2H3,(H,23,25)(H,22,24,26);5-8,10-12H,9H2,1-4H3,(H,23,25)(H,22,24,26);4-7,9-11H,8H2,1-3H3,(H,23,25)(H,22,24,26);4-7,9-11H,8H2,1-3H3,(H,22,24)(H,21,23,25).

What are the key properties of 3-(2,3-dihydro-1-benzofuran-5-yl)-5-[5-(2-methylpropyl)-1H-1,2,4-triazol-3-yl]-1H-indazole;3-(4-fluoro-3-methylphenyl)-5-[5-(2-methylpropyl)-1H-1,2,4-triazol-3-yl]-1H-indazole;3-(4-methoxy-3-methylphenyl)-5-[5-(2-methylpropyl)-1H-1,2,4-triazol-3-yl]-1H-indazole;3-(6-methoxy-3-pyridinyl)-5-[5-(2-methylpropyl)-1H-1,2,4-triazol-3-yl]-1H-indazole?

3-(2,3-dihydro-1-benzofuran-5-yl)-5-[5-(2-methylpropyl)-1H-1,2,4-triazol-3-yl]-1H-indazole;3-(4-fluoro-3-methylphenyl)-5-[5-(2-methylpropyl)-1H-1,2,4-triazol-3-yl]-1H-indazole;3-(4-methoxy-3-methylphenyl)-5-[5-(2-methylpropyl)-1H-1,2,4-triazol-3-yl]-1H-indazole;3-(6-methoxy-3-pyridinyl)-5-[5-(2-methylpropyl)-1H-1,2,4-triazol-3-yl]-1H-indazole has a molecular weight of 1418.70 g/mol, XLogP of 16.96, 18 rotatable bonds, 8 hydrogen bond donors, and 16 hydrogen bond acceptors.

Where does this data come from?

All data for 3-(2,3-dihydro-1-benzofuran-5-yl)-5-[5-(2-methylpropyl)-1H-1,2,4-triazol-3-yl]-1H-indazole;3-(4-fluoro-3-methylphenyl)-5-[5-(2-methylpropyl)-1H-1,2,4-triazol-3-yl]-1H-indazole;3-(4-methoxy-3-methylphenyl)-5-[5-(2-methylpropyl)-1H-1,2,4-triazol-3-yl]-1H-indazole;3-(6-methoxy-3-pyridinyl)-5-[5-(2-methylpropyl)-1H-1,2,4-triazol-3-yl]-1H-indazole is sourced from PubChem (CID 159410724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).