About 5-[5-[(3R)-1-[(2,6-difluorophenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-3-(4-propan-2-ylsulfonylphenyl)-1H-indazole;2-[5-[5-[5-[(3R)-1-[(2-fluoro-6-methoxyphenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-1H-indazol-3-yl]-3-pyridinyl]propan-2-ol;5-[5-[(3R)-1-[(2-fluoro-6-methoxyphenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-3-(4-propan-2-yloxyphenyl)-1H-indazole;5-[5-[1-[(2-fluoro-6-methylphenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-3-(4-fluorophenyl)-1H-indazole
5-[5-[(3R)-1-[(2,6-difluorophenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-3-(4-propan-2-ylsulfonylphenyl)-1H-indazole;2-[5-[5-[5-[(3R)-1-[(2-fluoro-6-methoxyphenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-1H-indazol-3-yl]-3-pyridinyl]propan-2-ol;5-[5-[(3R)-1-[(2-fluoro-6-methoxyphenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-3-(4-propan-2-yloxyphenyl)-1H-indazole;5-[5-[1-[(2-fluoro-6-methylphenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-3-(4-fluorophenyl)-1H-indazole (PubChem CID 159828692) has the molecular formula C119H121F6N25O6S
and a molecular weight of 2143.50 g/mol. Its IUPAC name is 5-[5-[(3R)-1-[(2,6-difluorophenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-3-(4-propan-2-ylsulfonylphenyl)-1H-indazole;2-[5-[5-[5-[(3R)-1-[(2-fluoro-6-methoxyphenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-1H-indazol-3-yl]-3-pyridinyl]propan-2-ol;5-[5-[(3R)-1-[(2-fluoro-6-methoxyphenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-3-(4-propan-2-yloxyphenyl)-1H-indazole;5-[5-[1-[(2-fluoro-6-methylphenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-3-(4-fluorophenyl)-1H-indazole.
Frequently Asked Questions
What is the IUPAC name of 5-[5-[(3R)-1-[(2,6-difluorophenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-3-(4-propan-2-ylsulfonylphenyl)-1H-indazole;2-[5-[5-[5-[(3R)-1-[(2-fluoro-6-methoxyphenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-1H-indazol-3-yl]-3-pyridinyl]propan-2-ol;5-[5-[(3R)-1-[(2-fluoro-6-methoxyphenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-3-(4-propan-2-yloxyphenyl)-1H-indazole;5-[5-[1-[(2-fluoro-6-methylphenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-3-(4-fluorophenyl)-1H-indazole?
The IUPAC name of 5-[5-[(3R)-1-[(2,6-difluorophenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-3-(4-propan-2-ylsulfonylphenyl)-1H-indazole;2-[5-[5-[5-[(3R)-1-[(2-fluoro-6-methoxyphenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-1H-indazol-3-yl]-3-pyridinyl]propan-2-ol;5-[5-[(3R)-1-[(2-fluoro-6-methoxyphenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-3-(4-propan-2-yloxyphenyl)-1H-indazole;5-[5-[1-[(2-fluoro-6-methylphenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-3-(4-fluorophenyl)-1H-indazole (CID 159828692) is 5-[5-[(3R)-1-[(2,6-difluorophenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-3-(4-propan-2-ylsulfonylphenyl)-1H-indazole;2-[5-[5-[5-[(3R)-1-[(2-fluoro-6-methoxyphenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-1H-indazol-3-yl]-3-pyridinyl]propan-2-ol;5-[5-[(3R)-1-[(2-fluoro-6-methoxyphenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-3-(4-propan-2-yloxyphenyl)-1H-indazole;5-[5-[1-[(2-fluoro-6-methylphenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-3-(4-fluorophenyl)-1H-indazole.
What is the SMILES notation for 5-[5-[(3R)-1-[(2,6-difluorophenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-3-(4-propan-2-ylsulfonylphenyl)-1H-indazole;2-[5-[5-[5-[(3R)-1-[(2-fluoro-6-methoxyphenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-1H-indazol-3-yl]-3-pyridinyl]propan-2-ol;5-[5-[(3R)-1-[(2-fluoro-6-methoxyphenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-3-(4-propan-2-yloxyphenyl)-1H-indazole;5-[5-[1-[(2-fluoro-6-methylphenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-3-(4-fluorophenyl)-1H-indazole?
The canonical SMILES for 5-[5-[(3R)-1-[(2,6-difluorophenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-3-(4-propan-2-ylsulfonylphenyl)-1H-indazole;2-[5-[5-[5-[(3R)-1-[(2-fluoro-6-methoxyphenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-1H-indazol-3-yl]-3-pyridinyl]propan-2-ol;5-[5-[(3R)-1-[(2-fluoro-6-methoxyphenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-3-(4-propan-2-yloxyphenyl)-1H-indazole;5-[5-[1-[(2-fluoro-6-methylphenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-3-(4-fluorophenyl)-1H-indazole is CC(C)S(=O)(=O)c1ccc(-c2n[nH]c3ccc(-c4n[nH]c([C@@H]5CCCN(Cc6c(F)cccc6F)C5)n4)cc23)cc1.COc1cccc(F)c1CN1CCC[C@@H](c2nc(-c3ccc4[nH]nc(-c5ccc(OC(C)C)cc5)c4c3)n[nH]2)C1.COc1cccc(F)c1CN1CCC[C@@H](c2nc(-c3ccc4[nH]nc(-c5cncc(C(C)(C)O)c5)c4c3)n[nH]2)C1.Cc1cccc(F)c1CN1CCCC(c2nc(-c3ccc4[nH]nc(-c5ccc(F)cc5)c4c3)n[nH]2)C1.
What is the InChIKey of 5-[5-[(3R)-1-[(2,6-difluorophenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-3-(4-propan-2-ylsulfonylphenyl)-1H-indazole;2-[5-[5-[5-[(3R)-1-[(2-fluoro-6-methoxyphenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-1H-indazol-3-yl]-3-pyridinyl]propan-2-ol;5-[5-[(3R)-1-[(2-fluoro-6-methoxyphenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-3-(4-propan-2-yloxyphenyl)-1H-indazole;5-[5-[1-[(2-fluoro-6-methylphenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-3-(4-fluorophenyl)-1H-indazole?
The InChIKey is NNEDZEZJFTWKEX-VRGBEZNVSA-N. The full InChI is InChI=1S/C31H33FN6O2.C30H30F2N6O2S.C30H32FN7O2.C28H26F2N6/c1-19(2)40-23-12-9-20(10-13-23)29-24-16-21(11-14-27(24)34-35-29)30-33-31(37-36-30)22-6-5-15-38(17-22)18-25-26(32)7-4-8-28(25)39-3;1-18(2)41(39,40)22-11-8-19(9-12-22)28-23-15-20(10-13-27(23)34-35-28)29-33-30(37-36-29)21-5-4-14-38(16-21)17-24-25(31)6-3-7-26(24)32;1-30(2,39)21-12-20(14-32-15-21)27-22-13-18(9-10-25(22)34-35-27)28-33-29(37-36-28)19-6-5-11-38(16-19)17-23-24(31)7-4-8-26(23)40-3;1-17-4-2-6-24(30)23(17)16-36-13-3-5-20(15-36)28-31-27(34-35-28)19-9-12-25-22(14-19)26(33-32-25)18-7-10-21(29)11-8-18/h4,7-14,16,19,22H,5-6,15,17-18H2,1-3H3,(H,34,35)(H,33,36,37);3,6-13,15,18,21H,4-5,14,16-17H2,1-2H3,(H,34,35)(H,33,36,37);4,7-10,12-15,19,39H,5-6,11,16-17H2,1-3H3,(H,34,35)(H,33,36,37);2,4,6-12,14,20H,3,5,13,15-16H2,1H3,(H,32,33)(H,31,34,35)/t22-;21-;19-;/m111./s1.
What are the key properties of 5-[5-[(3R)-1-[(2,6-difluorophenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-3-(4-propan-2-ylsulfonylphenyl)-1H-indazole;2-[5-[5-[5-[(3R)-1-[(2-fluoro-6-methoxyphenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-1H-indazol-3-yl]-3-pyridinyl]propan-2-ol;5-[5-[(3R)-1-[(2-fluoro-6-methoxyphenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-3-(4-propan-2-yloxyphenyl)-1H-indazole;5-[5-[1-[(2-fluoro-6-methylphenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-3-(4-fluorophenyl)-1H-indazole?
5-[5-[(3R)-1-[(2,6-difluorophenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-3-(4-propan-2-ylsulfonylphenyl)-1H-indazole;2-[5-[5-[5-[(3R)-1-[(2-fluoro-6-methoxyphenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-1H-indazol-3-yl]-3-pyridinyl]propan-2-ol;5-[5-[(3R)-1-[(2-fluoro-6-methoxyphenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-3-(4-propan-2-yloxyphenyl)-1H-indazole;5-[5-[1-[(2-fluoro-6-methylphenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-3-(4-fluorophenyl)-1H-indazole has a molecular weight of 2143.50 g/mol, XLogP of 23.33, 27 rotatable bonds, 9 hydrogen bond donors, and 23 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[5-[(3R)-1-[(2,6-difluorophenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-3-(4-propan-2-ylsulfonylphenyl)-1H-indazole;2-[5-[5-[5-[(3R)-1-[(2-fluoro-6-methoxyphenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-1H-indazol-3-yl]-3-pyridinyl]propan-2-ol;5-[5-[(3R)-1-[(2-fluoro-6-methoxyphenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-3-(4-propan-2-yloxyphenyl)-1H-indazole;5-[5-[1-[(2-fluoro-6-methylphenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-3-(4-fluorophenyl)-1H-indazole is sourced from PubChem (CID 159828692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).