5-[5-[(3R)-1-(1-benzothiophen-3-ylmethyl)piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-3-pyridin-4-yl-1H-indazole;4-[5-[5-[(3R)-1-[(2,6-difluorophenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-1H-indazol-3-yl]pyridin-2-amine;6-[5-[5-[(3R)-1-[(2,6-difluorophenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-1H-indazol-3-yl]-[1,2,4]triazolo[1,5-a]pyridine;3-(2,3-dihydro-1-benzofuran-5-yl)-5-[5-[(3R)-1-[(2-fluoro-6-methoxyphenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-1H-indazole;5-[5-[(3R)-1-[(3-methylthiophen-2-yl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-3-pyridin-4-yl-1H-indazole

C136H126F5N37O2S2 — CID 159683798

IUPAC5-[5-[(3R)-1-(1-benzothiophen-3-ylmethyl)piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-3-pyridin-4-yl-1H-indazole;4-[5-[5-[(3R)-1-[(2,6-difluorophenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-1H-indazol-3-yl]pyridin-2-amine;6-[5-[5-[(3R)-1-[(2,6-difluorophenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-1H-indazol-3-yl]-[1,2,4]triazolo[1,5-a]pyridine;3-(2,3-dihydro-1-benzofuran-5-yl)-5-[5-[(3R)-1-[(2-fluoro-6-methoxyphenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-1H-indazole;5-[5-[(3R)-1-[(3-methylthiophen-2-yl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-3-pyridin-4-yl-1H-indazole
SMILESCOc1cccc(F)c1CN1CCC[C@@H](c2nc(-c3ccc4[nH]nc(-c5ccc6c(c5)CCO6)c4c3)n[nH]2)C1.Cc1ccsc1CN1CCC[C@@H](c2nc(-c3ccc4[nH]nc(-c5ccncc5)c4c3)n[nH]2)C1.Fc1cccc(F)c1CN1CCC[C@@H](c2nc(-c3ccc4[nH]nc(-c5ccc6ncnn6c5)c4c3)n[nH]2)C1.Nc1cc(-c2n[nH]c3ccc(-c4n[nH]c([C@@H]5CCCN(Cc6c(F)cccc6F)C5)n4)cc23)ccn1.c1ccc2c(CN3CCC[C@@H](c4nc(-c5ccc6[nH]nc(-c7ccncc7)c6c5)n[nH]4)C3)csc2c1
InChIInChI=1S/C30H29FN6O2.C28H25N7S.C27H23F2N9.C26H24F2N8.C25H25N7S/c1-38-27-6-2-5-24(31)23(27)17-37-12-3-4-21(16-37)30-32-29(35-36-30)20-7-9-25-22(15-20)28(34-33-25)19-8-10-26-18(14-19)11-13-39-26;1-2-6-25-22(5-1)21(17-36-25)16-35-13-3-4-20(15-35)28-30-27(33-34-28)19-7-8-24-23(14-19)26(32-31-24)18-9-11-29-12-10-18;28-21-4-1-5-22(29)20(21)14-37-10-2-3-18(12-37)27-32-26(35-36-27)16-6-8-23-19(11-16)25(34-33-23)17-7-9-24-30-15-31-38(24)13-17;27-20-4-1-5-21(28)19(20)14-36-10-2-3-17(13-36)26-31-25(34-35-26)16-6-7-22-18(11-16)24(33-32-22)15-8-9-30-23(29)12-15;1-16-8-12-33-22(16)15-32-11-2-3-19(14-32)25-27-24(30-31-25)18-4-5-21-20(13-18)23(29-28-21)17-6-9-26-10-7-17/h2,5-10,14-15,21H,3-4,11-13,16-17H2,1H3,(H,33,34)(H,32,35,36);1-2,5-12,14,17,20H,3-4,13,15-16H2,(H,31,32)(H,30,33,34);1,4-9,11,13,15,18H,2-3,10,12,14H2,(H,33,34)(H,32,35,36);1,4-9,11-12,17H,2-3,10,13-14H2,(H2,29,30)(H,32,33)(H,31,34,35);4-10,12-13,19H,2-3,11,14-15H2,1H3,(H,28,29)(H,27,30,31)/t21-;20-;18-;17-;19-/m11111/s1
InChIKeyMVNNXZTXXACAEH-FZBXJGOWSA-N
MW2469.88 g/mol
LogP26.01
Rot. Bonds26

About 5-[5-[(3R)-1-(1-benzothiophen-3-ylmethyl)piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-3-pyridin-4-yl-1H-indazole;4-[5-[5-[(3R)-1-[(2,6-difluorophenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-1H-indazol-3-yl]pyridin-2-amine;6-[5-[5-[(3R)-1-[(2,6-difluorophenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-1H-indazol-3-yl]-[1,2,4]triazolo[1,5-a]pyridine;3-(2,3-dihydro-1-benzofuran-5-yl)-5-[5-[(3R)-1-[(2-fluoro-6-methoxyphenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-1H-indazole;5-[5-[(3R)-1-[(3-methylthiophen-2-yl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-3-pyridin-4-yl-1H-indazole

5-[5-[(3R)-1-(1-benzothiophen-3-ylmethyl)piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-3-pyridin-4-yl-1H-indazole;4-[5-[5-[(3R)-1-[(2,6-difluorophenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-1H-indazol-3-yl]pyridin-2-amine;6-[5-[5-[(3R)-1-[(2,6-difluorophenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-1H-indazol-3-yl]-[1,2,4]triazolo[1,5-a]pyridine;3-(2,3-dihydro-1-benzofuran-5-yl)-5-[5-[(3R)-1-[(2-fluoro-6-methoxyphenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-1H-indazole;5-[5-[(3R)-1-[(3-methylthiophen-2-yl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-3-pyridin-4-yl-1H-indazole (PubChem CID 159683798) has the molecular formula C136H126F5N37O2S2 and a molecular weight of 2469.88 g/mol. Its IUPAC name is 5-[5-[(3R)-1-(1-benzothiophen-3-ylmethyl)piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-3-pyridin-4-yl-1H-indazole;4-[5-[5-[(3R)-1-[(2,6-difluorophenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-1H-indazol-3-yl]pyridin-2-amine;6-[5-[5-[(3R)-1-[(2,6-difluorophenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-1H-indazol-3-yl]-[1,2,4]triazolo[1,5-a]pyridine;3-(2,3-dihydro-1-benzofuran-5-yl)-5-[5-[(3R)-1-[(2-fluoro-6-methoxyphenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-1H-indazole;5-[5-[(3R)-1-[(3-methylthiophen-2-yl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-3-pyridin-4-yl-1H-indazole.

Molecular Properties

Compound Name5-[5-[(3R)-1-(1-benzothiophen-3-ylmethyl)piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-3-pyridin-4-yl-1H-indazole;4-[5-[5-[(3R)-1-[(2,6-difluorophenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-1H-indazol-3-yl]pyridin-2-amine;6-[5-[5-[(3R)-1-[(2,6-difluorophenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-1H-indazol-3-yl]-[1,2,4]triazolo[1,5-a]pyridine;3-(2,3-dihydro-1-benzofuran-5-yl)-5-[5-[(3R)-1-[(2-fluoro-6-methoxyphenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-1H-indazole;5-[5-[(3R)-1-[(3-methylthiophen-2-yl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-3-pyridin-4-yl-1H-indazole
PubChem CID159683798
Molecular FormulaC136H126F5N37O2S2
Molecular Weight2469.88 g/mol
Exact Mass2468.03
IUPAC Name5-[5-[(3R)-1-(1-benzothiophen-3-ylmethyl)piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-3-pyridin-4-yl-1H-indazole;4-[5-[5-[(3R)-1-[(2,6-difluorophenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-1H-indazol-3-yl]pyridin-2-amine;6-[5-[5-[(3R)-1-[(2,6-difluorophenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-1H-indazol-3-yl]-[1,2,4]triazolo[1,5-a]pyridine;3-(2,3-dihydro-1-benzofuran-5-yl)-5-[5-[(3R)-1-[(2-fluoro-6-methoxyphenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-1H-indazole;5-[5-[(3R)-1-[(3-methylthiophen-2-yl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-3-pyridin-4-yl-1H-indazole
SMILESCOc1cccc(F)c1CN1CCC[C@@H](c2nc(-c3ccc4[nH]nc(-c5ccc6c(c5)CCO6)c4c3)n[nH]2)C1.Cc1ccsc1CN1CCC[C@@H](c2nc(-c3ccc4[nH]nc(-c5ccncc5)c4c3)n[nH]2)C1.Fc1cccc(F)c1CN1CCC[C@@H](c2nc(-c3ccc4[nH]nc(-c5ccc6ncnn6c5)c4c3)n[nH]2)C1.Nc1cc(-c2n[nH]c3ccc(-c4n[nH]c([C@@H]5CCCN(Cc6c(F)cccc6F)C5)n4)cc23)ccn1.c1ccc2c(CN3CCC[C@@H](c4nc(-c5ccc6[nH]nc(-c7ccncc7)c6c5)n[nH]4)C3)csc2c1
InChIInChI=1S/C30H29FN6O2.C28H25N7S.C27H23F2N9.C26H24F2N8.C25H25N7S/c1-38-27-6-2-5-24(31)23(27)17-37-12-3-4-21(16-37)30-32-29(35-36-30)20-7-9-25-22(15-20)28(34-33-25)19-8-10-26-18(14-19)11-13-39-26;1-2-6-25-22(5-1)21(17-36-25)16-35-13-3-4-20(15-35)28-30-27(33-34-28)19-7-8-24-23(14-19)26(32-31-24)18-9-11-29-12-10-18;28-21-4-1-5-22(29)20(21)14-37-10-2-3-18(12-37)27-32-26(35-36-27)16-6-8-23-19(11-16)25(34-33-23)17-7-9-24-30-15-31-38(24)13-17;27-20-4-1-5-21(28)19(20)14-36-10-2-3-17(13-36)26-31-25(34-35-26)16-6-7-22-18(11-16)24(33-32-22)15-8-9-30-23(29)12-15;1-16-8-12-33-22(16)15-32-11-2-3-19(14-32)25-27-24(30-31-25)18-4-5-21-20(13-18)23(29-28-21)17-6-9-26-10-7-17/h2,5-10,14-15,21H,3-4,11-13,16-17H2,1H3,(H,33,34)(H,32,35,36);1-2,5-12,14,17,20H,3-4,13,15-16H2,(H,31,32)(H,30,33,34);1,4-9,11,13,15,18H,2-3,10,12,14H2,(H,33,34)(H,32,35,36);1,4-9,11-12,17H,2-3,10,13-14H2,(H2,29,30)(H,32,33)(H,31,34,35);4-10,12-13,19H,2-3,11,14-15H2,1H3,(H,28,29)(H,27,30,31)/t21-;20-;18-;17-;19-/m11111/s1
InChIKeyMVNNXZTXXACAEH-FZBXJGOWSA-N
XLogP26.01
TPSA480.79 Ų
H-Bond Donors11
H-Bond Acceptors31
Rotatable Bonds26
Heavy Atoms182
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002469.88
LogP ≤ 526.01
H-Bond Donors ≤ 511
H-Bond Acceptors ≤ 1031

Analyze 5-[5-[(3R)-1-(1-benzothiophen-3-ylmethyl)piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-3-pyridin-4-yl-1H-indazole;4-[5-[5-[(3R)-1-[(2,6-difluorophenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-1H-indazol-3-yl]pyridin-2-amine;6-[5-[5-[(3R)-1-[(2,6-difluorophenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-1H-indazol-3-yl]-[1,2,4]triazolo[1,5-a]pyridine;3-(2,3-dihydro-1-benzofuran-5-yl)-5-[5-[(3R)-1-[(2-fluoro-6-methoxyphenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-1H-indazole;5-[5-[(3R)-1-[(3-methylthiophen-2-yl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-3-pyridin-4-yl-1H-indazole with MolForge

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Related Compounds

CID 157335544
CID 157335544
4-chloro-1-(1,1-difluoroethyl)-2-propan-2-ylbenzene;5-chloro-3-(1,1-difluoroethyl)-2-propan-2-ylpyridine;2,4-dichloro-6-propan-2-ylpyridine;1-(1,1-difluoroethyl)-4-fluoro-2-methylbenzene;5-ethyl-2-propan-2-ylpyridine;1-fluoro-3-methoxy-2-propan-2-ylbenzene;6-methoxy-3-methyl-2-propan-2-ylpyridine;5-methyl-3-propan-2-yl-1-benzothiophene;1-methyl-4-propan-2-ylindazole;1-(3-methyl-4-propan-2-ylphenyl)-1,2,4-triazole;3-methyl-2-propan-2-yl-5-(trifluoromethyl)pyridine;1-methylsulfinyl-2-propan-2-ylbenzene;2-propan-2-ylimidazo[1,2-b]pyridazine;4-propan-2-yl-1H-indazole
CID 157351327
3-(2-chloro-3-fluorophenyl)-4-thiophen-3-yl-2H-pyrazolo[3,4-b]pyridine;3-(4-chloro-2-fluorophenyl)-4-thiophen-3-yl-2H-pyrazolo[3,4-b]pyridine;3-(4-chloro-2-methoxyphenyl)-4-thiophen-3-yl-2H-pyrazolo[3,4-b]pyridine;3-(2,4-difluorophenyl)-4-thiophen-3-yl-2H-pyrazolo[3,4-b]pyridine;3-(2-ethoxyphenyl)-4-thiophen-3-yl-2H-pyrazolo[3,4-b]pyridine;3-(4-fluoro-2-methoxyphenyl)-4-thiophen-3-yl-2H-pyrazolo[3,4-b]pyridine;3-(2-fluorophenyl)-4-thiophen-3-yl-2H-pyrazolo[3,4-b]pyridine;3-(2-methoxyphenyl)-4-thiophen-3-yl-2H-pyrazolo[3,4-b]pyridine;3-(4-methoxyphenyl)-4-thiophen-3-yl-2H-pyrazolo[3,4-b]pyridine;3-[4-(4-methylpiperazin-1-yl)phenyl]-4-thiophen-3-yl-2H-pyrazolo[3,4-b]pyridine;4-thiophen-3-yl-3-[2-(trifluoromethyl)phenyl]-2H-pyrazolo[3,4-b]pyridine;2,2,2-trifluoro-1-[4-[4-(4-thiophen-3-yl-2H-pyrazolo[3,4-b]pyridin-3-yl)phenyl]piperazin-1-yl]ethanone
CID 157526514
2-(2,3-Dihydro-1-benzofuran-5-yl)-4-methyl-1,3-thiazole;4,5-dimethyl-1-phenylpyrazole;3,5-dimethyl-1-[3-(trifluoromethyl)phenyl]-1,2,4-triazole;2-(4-fluorophenoxy)-3-methylpyridine;1-(4-fluorophenyl)-4,5-dimethylpyrazole;1-(4-fluorophenyl)-4-methyl-5-(trifluoromethyl)pyrazole;3-methyl-2-phenoxypyridine;5-methyl-2-phenoxypyridine;3-methyl-5-phenylpyridine;4-methyl-1-phenyl-5-(trifluoromethyl)pyrazole;4-methyl-2-piperidin-1-ylpyridine;5-methyl-2-piperidin-1-ylpyridine
CID 157837412
7-(2,4-Difluorophenyl)-8-(2,6-dimethyl-4-pyridinyl)-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;7-(2,4-difluorophenyl)-8-[2-methyl-6-(trifluoromethyl)-4-pyridinyl]-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(2,6-dimethyl-4-pyridinyl)-2-methyl-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;7-(4-fluoro-2-methoxyphenyl)-8-[2-methyl-6-(trifluoromethyl)-4-pyridinyl]-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;2-methyl-8-[2-methyl-6-(trifluoromethyl)-4-pyridinyl]-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;7-(1-methylpyrazol-3-yl)-8-[2-methyl-6-(trifluoromethyl)-4-pyridinyl]-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-[2-methyl-6-(trifluoromethyl)-4-pyridinyl]-7-(1,3-thiazol-2-yl)-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine
CID 158035203
2-chloro-4-methylpyridine;4,5-dimethyl-1H-pyrazole;2,5-dimethylpyrimidine;2,4-dimethylthiophene;2,5-dimethylthiophene;1,4-dimethyl-3-(trifluoromethyl)pyrazole;1,4-dimethyl-5-(trifluoromethyl)pyrazole;bis(4,5-dimethyl-3-(trifluoromethyl)-1H-pyrazole);2-methoxy-4-methylthiophene;5-methyl-2,3-dihydro-1-benzofuran;1-methylimidazole;5-methyl-2-piperidin-1-ylpyridine;3-methylpyridine;4-(5-methyl-2-pyridinyl)morpholine;5-methylpyrimidin-2-amine;bis(4-methyl-5-(trifluoromethyl)-1H-pyrazole);bis(1,3,4,5-tetramethylpyrazole);1,3,4-trimethylpyrazole;1,4,5-trimethylpyrazole;bis(3,4,5-trimethyl-1H-pyrazole);1,3,4-trimethyl-5-(trifluoromethyl)pyrazole
CID 158394229
3-(2-chloro-3-fluorophenyl)-4-(5-chlorothiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;3-(4-chloro-2-fluorophenyl)-4-(5-chlorothiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;3-(4-chloro-2-methoxyphenyl)-4-(5-chlorothiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;3-(3-chlorophenyl)-4-(5-chlorothiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;4-(5-chlorothiophen-2-yl)-3-(2-ethoxyphenyl)-2H-pyrazolo[3,4-b]pyridine;4-(5-chlorothiophen-2-yl)-3-(4-fluoro-2-methoxyphenyl)-2H-pyrazolo[3,4-b]pyridine;4-(5-chlorothiophen-2-yl)-3-(2-fluorophenyl)-2H-pyrazolo[3,4-b]pyridine;4-(5-chlorothiophen-2-yl)-3-(4-methoxyphenyl)-2H-pyrazolo[3,4-b]pyridine;4-[3-[4-(5-chlorothiophen-2-yl)-2H-pyrazolo[3,4-b]pyridin-3-yl]-2-pyridinyl]morpholine;4-(5-chlorothiophen-2-yl)-3-[2-(trifluoromethyl)phenyl]-2H-pyrazolo[3,4-b]pyridine;3-(2-methoxy-3-pyridinyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine
CID 158666103
5-[1-[5,5-difluoro-1-[(2-fluoro-6-methoxyphenyl)methyl]piperidin-3-yl]triazol-4-yl]-3-pyridin-4-yl-1H-indazole;5-[1-[5,5-difluoro-1-[(2-fluoro-6-methylphenyl)methyl]piperidin-3-yl]triazol-4-yl]-3-pyridin-4-yl-1H-indazole;5-[5-[1-[(2-fluoro-6-methoxyphenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-3-pyridin-4-yl-1H-indazole;5-[5-[(3R)-1-[(2-fluoro-6-methoxyphenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-3-pyridin-4-yl-1H-indazole
CID 158898437
3-(2-chloro-3-fluorophenyl)-4-(5-chlorothiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;3-(4-chloro-2-fluorophenyl)-4-(5-chlorothiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;3-(4-chloro-2-methoxyphenyl)-4-(5-chlorothiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;3-(3-chlorophenyl)-4-(5-chlorothiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine;4-(5-chlorothiophen-2-yl)-3-(2-ethoxyphenyl)-2H-pyrazolo[3,4-b]pyridine;4-(5-chlorothiophen-2-yl)-3-(4-fluoro-2-methoxyphenyl)-2H-pyrazolo[3,4-b]pyridine;4-(5-chlorothiophen-2-yl)-3-(2-fluorophenyl)-2H-pyrazolo[3,4-b]pyridine;4-(5-chlorothiophen-2-yl)-3-(4-methoxyphenyl)-2H-pyrazolo[3,4-b]pyridine;4-(5-chlorothiophen-2-yl)-3-[2-(trifluoromethyl)phenyl]-2H-pyrazolo[3,4-b]pyridine;3-(2-methoxy-3-pyridinyl)-4-(5-methylthiophen-2-yl)-2H-pyrazolo[3,4-b]pyridine
CID 159047700
3-[2-fluoro-5-(4-methylpiperazin-1-yl)phenyl]-4-thiophen-3-yl-2H-pyrazolo[3,4-b]pyridine;3-[2-fluoro-5-(4-methylpiperazin-1-yl)-3-pyridinyl]-4-thiophen-3-yl-2H-pyrazolo[3,4-b]pyridine;4-[6-fluoro-5-(4-thiophen-3-yl-2H-pyrazolo[3,4-b]pyridin-3-yl)-3-pyridinyl]morpholine;N-[3-(4-methylpiperazin-1-yl)phenyl]-4-thiophen-3-yl-2H-pyrazolo[3,4-b]pyridin-3-amine;N-(3-morpholin-4-ylphenyl)-4-thiophen-3-yl-2H-pyrazolo[3,4-b]pyridin-3-amine;4-[3-(4-thiophen-3-yl-2H-pyrazolo[3,4-b]pyridin-3-yl)-4-(trifluoromethoxy)phenyl]morpholine
CID 159106309
3-[2-fluoro-5-(4-methylpiperazin-1-yl)-3-pyridinyl]-4-thiophen-3-yl-2H-pyrazolo[3,4-b]pyridine;N-[3-(4-methylpiperazin-1-yl)phenyl]-4-thiophen-3-yl-2H-pyrazolo[3,4-b]pyridin-3-amine;3-[5-(4-methylpiperazin-1-yl)-2-(trifluoromethoxy)phenyl]-4-thiophen-3-yl-2H-pyrazolo[3,4-b]pyridine;N-(3-morpholin-4-ylphenyl)-4-thiophen-3-yl-2H-pyrazolo[3,4-b]pyridin-3-amine;4-[3-(4-thiophen-3-yl-2H-pyrazolo[3,4-b]pyridin-3-yl)-4-(trifluoromethoxy)phenyl]morpholine
CID 159154801
CID 160274858
CID 160274858

Frequently Asked Questions

What is the IUPAC name of 5-[5-[(3R)-1-(1-benzothiophen-3-ylmethyl)piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-3-pyridin-4-yl-1H-indazole;4-[5-[5-[(3R)-1-[(2,6-difluorophenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-1H-indazol-3-yl]pyridin-2-amine;6-[5-[5-[(3R)-1-[(2,6-difluorophenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-1H-indazol-3-yl]-[1,2,4]triazolo[1,5-a]pyridine;3-(2,3-dihydro-1-benzofuran-5-yl)-5-[5-[(3R)-1-[(2-fluoro-6-methoxyphenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-1H-indazole;5-[5-[(3R)-1-[(3-methylthiophen-2-yl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-3-pyridin-4-yl-1H-indazole?
The IUPAC name of 5-[5-[(3R)-1-(1-benzothiophen-3-ylmethyl)piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-3-pyridin-4-yl-1H-indazole;4-[5-[5-[(3R)-1-[(2,6-difluorophenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-1H-indazol-3-yl]pyridin-2-amine;6-[5-[5-[(3R)-1-[(2,6-difluorophenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-1H-indazol-3-yl]-[1,2,4]triazolo[1,5-a]pyridine;3-(2,3-dihydro-1-benzofuran-5-yl)-5-[5-[(3R)-1-[(2-fluoro-6-methoxyphenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-1H-indazole;5-[5-[(3R)-1-[(3-methylthiophen-2-yl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-3-pyridin-4-yl-1H-indazole (CID 159683798) is 5-[5-[(3R)-1-(1-benzothiophen-3-ylmethyl)piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-3-pyridin-4-yl-1H-indazole;4-[5-[5-[(3R)-1-[(2,6-difluorophenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-1H-indazol-3-yl]pyridin-2-amine;6-[5-[5-[(3R)-1-[(2,6-difluorophenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-1H-indazol-3-yl]-[1,2,4]triazolo[1,5-a]pyridine;3-(2,3-dihydro-1-benzofuran-5-yl)-5-[5-[(3R)-1-[(2-fluoro-6-methoxyphenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-1H-indazole;5-[5-[(3R)-1-[(3-methylthiophen-2-yl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-3-pyridin-4-yl-1H-indazole.
What is the SMILES notation for 5-[5-[(3R)-1-(1-benzothiophen-3-ylmethyl)piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-3-pyridin-4-yl-1H-indazole;4-[5-[5-[(3R)-1-[(2,6-difluorophenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-1H-indazol-3-yl]pyridin-2-amine;6-[5-[5-[(3R)-1-[(2,6-difluorophenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-1H-indazol-3-yl]-[1,2,4]triazolo[1,5-a]pyridine;3-(2,3-dihydro-1-benzofuran-5-yl)-5-[5-[(3R)-1-[(2-fluoro-6-methoxyphenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-1H-indazole;5-[5-[(3R)-1-[(3-methylthiophen-2-yl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-3-pyridin-4-yl-1H-indazole?
The canonical SMILES for 5-[5-[(3R)-1-(1-benzothiophen-3-ylmethyl)piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-3-pyridin-4-yl-1H-indazole;4-[5-[5-[(3R)-1-[(2,6-difluorophenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-1H-indazol-3-yl]pyridin-2-amine;6-[5-[5-[(3R)-1-[(2,6-difluorophenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-1H-indazol-3-yl]-[1,2,4]triazolo[1,5-a]pyridine;3-(2,3-dihydro-1-benzofuran-5-yl)-5-[5-[(3R)-1-[(2-fluoro-6-methoxyphenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-1H-indazole;5-[5-[(3R)-1-[(3-methylthiophen-2-yl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-3-pyridin-4-yl-1H-indazole is COc1cccc(F)c1CN1CCC[C@@H](c2nc(-c3ccc4[nH]nc(-c5ccc6c(c5)CCO6)c4c3)n[nH]2)C1.Cc1ccsc1CN1CCC[C@@H](c2nc(-c3ccc4[nH]nc(-c5ccncc5)c4c3)n[nH]2)C1.Fc1cccc(F)c1CN1CCC[C@@H](c2nc(-c3ccc4[nH]nc(-c5ccc6ncnn6c5)c4c3)n[nH]2)C1.Nc1cc(-c2n[nH]c3ccc(-c4n[nH]c([C@@H]5CCCN(Cc6c(F)cccc6F)C5)n4)cc23)ccn1.c1ccc2c(CN3CCC[C@@H](c4nc(-c5ccc6[nH]nc(-c7ccncc7)c6c5)n[nH]4)C3)csc2c1.
What is the InChIKey of 5-[5-[(3R)-1-(1-benzothiophen-3-ylmethyl)piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-3-pyridin-4-yl-1H-indazole;4-[5-[5-[(3R)-1-[(2,6-difluorophenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-1H-indazol-3-yl]pyridin-2-amine;6-[5-[5-[(3R)-1-[(2,6-difluorophenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-1H-indazol-3-yl]-[1,2,4]triazolo[1,5-a]pyridine;3-(2,3-dihydro-1-benzofuran-5-yl)-5-[5-[(3R)-1-[(2-fluoro-6-methoxyphenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-1H-indazole;5-[5-[(3R)-1-[(3-methylthiophen-2-yl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-3-pyridin-4-yl-1H-indazole?
The InChIKey is MVNNXZTXXACAEH-FZBXJGOWSA-N. The full InChI is InChI=1S/C30H29FN6O2.C28H25N7S.C27H23F2N9.C26H24F2N8.C25H25N7S/c1-38-27-6-2-5-24(31)23(27)17-37-12-3-4-21(16-37)30-32-29(35-36-30)20-7-9-25-22(15-20)28(34-33-25)19-8-10-26-18(14-19)11-13-39-26;1-2-6-25-22(5-1)21(17-36-25)16-35-13-3-4-20(15-35)28-30-27(33-34-28)19-7-8-24-23(14-19)26(32-31-24)18-9-11-29-12-10-18;28-21-4-1-5-22(29)20(21)14-37-10-2-3-18(12-37)27-32-26(35-36-27)16-6-8-23-19(11-16)25(34-33-23)17-7-9-24-30-15-31-38(24)13-17;27-20-4-1-5-21(28)19(20)14-36-10-2-3-17(13-36)26-31-25(34-35-26)16-6-7-22-18(11-16)24(33-32-22)15-8-9-30-23(29)12-15;1-16-8-12-33-22(16)15-32-11-2-3-19(14-32)25-27-24(30-31-25)18-4-5-21-20(13-18)23(29-28-21)17-6-9-26-10-7-17/h2,5-10,14-15,21H,3-4,11-13,16-17H2,1H3,(H,33,34)(H,32,35,36);1-2,5-12,14,17,20H,3-4,13,15-16H2,(H,31,32)(H,30,33,34);1,4-9,11,13,15,18H,2-3,10,12,14H2,(H,33,34)(H,32,35,36);1,4-9,11-12,17H,2-3,10,13-14H2,(H2,29,30)(H,32,33)(H,31,34,35);4-10,12-13,19H,2-3,11,14-15H2,1H3,(H,28,29)(H,27,30,31)/t21-;20-;18-;17-;19-/m11111/s1.
What are the key properties of 5-[5-[(3R)-1-(1-benzothiophen-3-ylmethyl)piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-3-pyridin-4-yl-1H-indazole;4-[5-[5-[(3R)-1-[(2,6-difluorophenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-1H-indazol-3-yl]pyridin-2-amine;6-[5-[5-[(3R)-1-[(2,6-difluorophenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-1H-indazol-3-yl]-[1,2,4]triazolo[1,5-a]pyridine;3-(2,3-dihydro-1-benzofuran-5-yl)-5-[5-[(3R)-1-[(2-fluoro-6-methoxyphenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-1H-indazole;5-[5-[(3R)-1-[(3-methylthiophen-2-yl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-3-pyridin-4-yl-1H-indazole?
5-[5-[(3R)-1-(1-benzothiophen-3-ylmethyl)piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-3-pyridin-4-yl-1H-indazole;4-[5-[5-[(3R)-1-[(2,6-difluorophenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-1H-indazol-3-yl]pyridin-2-amine;6-[5-[5-[(3R)-1-[(2,6-difluorophenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-1H-indazol-3-yl]-[1,2,4]triazolo[1,5-a]pyridine;3-(2,3-dihydro-1-benzofuran-5-yl)-5-[5-[(3R)-1-[(2-fluoro-6-methoxyphenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-1H-indazole;5-[5-[(3R)-1-[(3-methylthiophen-2-yl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-3-pyridin-4-yl-1H-indazole has a molecular weight of 2469.88 g/mol, XLogP of 26.01, 26 rotatable bonds, 11 hydrogen bond donors, and 31 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[5-[(3R)-1-(1-benzothiophen-3-ylmethyl)piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-3-pyridin-4-yl-1H-indazole;4-[5-[5-[(3R)-1-[(2,6-difluorophenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-1H-indazol-3-yl]pyridin-2-amine;6-[5-[5-[(3R)-1-[(2,6-difluorophenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-1H-indazol-3-yl]-[1,2,4]triazolo[1,5-a]pyridine;3-(2,3-dihydro-1-benzofuran-5-yl)-5-[5-[(3R)-1-[(2-fluoro-6-methoxyphenyl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-1H-indazole;5-[5-[(3R)-1-[(3-methylthiophen-2-yl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-3-yl]-3-pyridin-4-yl-1H-indazole is sourced from PubChem (CID 159683798), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).