2-[6-(2,7-diazaspiro[3.5]nonan-2-yl)pyridazin-3-yl]-5-(1H-pyrazol-4-yl)phenol;2-[6-(2,6-dimethylpiperidin-4-yl)oxypyridazin-3-yl]-5-pyrazol-1-ylphenol;2-[6-(2,6-dimethylpiperidin-4-yl)oxypyridazin-3-yl]-5-(1H-pyrazol-4-yl)phenol;3-fluoro-4-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenol;3-[2-fluoro-4-(1H-pyrazol-4-yl)phenyl]-6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazine;N-methyl-6-(2-methylindazol-5-yl)-N-(2,2,6,6-tetramethylpiperidin-4-yl)pyridazin-3-amine;3-[4-(1-methylpyrazol-4-yl)thiophen-2-yl]-6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazine
C145H178F2N36O8S — CID 159569568
Data last refreshed: (MolForge compound catalog, from PubChem)
About 2-[6-(2,7-diazaspiro[3.5]nonan-2-yl)pyridazin-3-yl]-5-(1H-pyrazol-4-yl)phenol;2-[6-(2,6-dimethylpiperidin-4-yl)oxypyridazin-3-yl]-5-pyrazol-1-ylphenol;2-[6-(2,6-dimethylpiperidin-4-yl)oxypyridazin-3-yl]-5-(1H-pyrazol-4-yl)phenol;3-fluoro-4-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenol;3-[2-fluoro-4-(1H-pyrazol-4-yl)phenyl]-6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazine;N-methyl-6-(2-methylindazol-5-yl)-N-(2,2,6,6-tetramethylpiperidin-4-yl)pyridazin-3-amine;3-[4-(1-methylpyrazol-4-yl)thiophen-2-yl]-6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazine
2-[6-(2,7-diazaspiro[3.5]nonan-2-yl)pyridazin-3-yl]-5-(1H-pyrazol-4-yl)phenol;2-[6-(2,6-dimethylpiperidin-4-yl)oxypyridazin-3-yl]-5-pyrazol-1-ylphenol;2-[6-(2,6-dimethylpiperidin-4-yl)oxypyridazin-3-yl]-5-(1H-pyrazol-4-yl)phenol;3-fluoro-4-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenol;3-[2-fluoro-4-(1H-pyrazol-4-yl)phenyl]-6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazine;N-methyl-6-(2-methylindazol-5-yl)-N-(2,2,6,6-tetramethylpiperidin-4-yl)pyridazin-3-amine;3-[4-(1-methylpyrazol-4-yl)thiophen-2-yl]-6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazine (PubChem CID 159569568) has the molecular formula C145H178F2N36O8S and a molecular weight of 2623.33 g/mol. Its IUPAC name is 2-[6-(2,7-diazaspiro[3.5]nonan-2-yl)pyridazin-3-yl]-5-(1H-pyrazol-4-yl)phenol;2-[6-(2,6-dimethylpiperidin-4-yl)oxypyridazin-3-yl]-5-pyrazol-1-ylphenol;2-[6-(2,6-dimethylpiperidin-4-yl)oxypyridazin-3-yl]-5-(1H-pyrazol-4-yl)phenol;3-fluoro-4-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenol;3-[2-fluoro-4-(1H-pyrazol-4-yl)phenyl]-6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazine;N-methyl-6-(2-methylindazol-5-yl)-N-(2,2,6,6-tetramethylpiperidin-4-yl)pyridazin-3-amine;3-[4-(1-methylpyrazol-4-yl)thiophen-2-yl]-6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazine.
Molecular Properties
| Compound Name | 2-[6-(2,7-diazaspiro[3.5]nonan-2-yl)pyridazin-3-yl]-5-(1H-pyrazol-4-yl)phenol;2-[6-(2,6-dimethylpiperidin-4-yl)oxypyridazin-3-yl]-5-pyrazol-1-ylphenol;2-[6-(2,6-dimethylpiperidin-4-yl)oxypyridazin-3-yl]-5-(1H-pyrazol-4-yl)phenol;3-fluoro-4-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenol;3-[2-fluoro-4-(1H-pyrazol-4-yl)phenyl]-6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazine;N-methyl-6-(2-methylindazol-5-yl)-N-(2,2,6,6-tetramethylpiperidin-4-yl)pyridazin-3-amine;3-[4-(1-methylpyrazol-4-yl)thiophen-2-yl]-6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazine |
|---|---|
| PubChem CID | 159569568 |
| Molecular Formula | C145H178F2N36O8S |
| Molecular Weight | 2623.33 g/mol |
| Exact Mass | 2621.43 |
| IUPAC Name | 2-[6-(2,7-diazaspiro[3.5]nonan-2-yl)pyridazin-3-yl]-5-(1H-pyrazol-4-yl)phenol;2-[6-(2,6-dimethylpiperidin-4-yl)oxypyridazin-3-yl]-5-pyrazol-1-ylphenol;2-[6-(2,6-dimethylpiperidin-4-yl)oxypyridazin-3-yl]-5-(1H-pyrazol-4-yl)phenol;3-fluoro-4-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenol;3-[2-fluoro-4-(1H-pyrazol-4-yl)phenyl]-6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazine;N-methyl-6-(2-methylindazol-5-yl)-N-(2,2,6,6-tetramethylpiperidin-4-yl)pyridazin-3-amine;3-[4-(1-methylpyrazol-4-yl)thiophen-2-yl]-6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazine |
| SMILES | CC1(C)CC(Oc2ccc(-c3ccc(-c4cn[nH]c4)cc3F)nn2)CC(C)(C)N1.CC1CC(Oc2ccc(-c3ccc(-c4cn[nH]c4)cc3O)nn2)CC(C)N1.CC1CC(Oc2ccc(-c3ccc(-n4cccn4)cc3O)nn2)CC(C)N1.CN(c1ccc(-c2ccc(O)cc2F)nn1)C1CC(C)(C)NC(C)(C)C1.CN(c1ccc(-c2ccc3nn(C)cc3c2)nn1)C1CC(C)(C)NC(C)(C)C1.Cn1cc(-c2csc(-c3ccc(OC4CC(C)(C)NC(C)(C)C4)nn3)c2)cn1.Oc1cc(-c2cn[nH]c2)ccc1-c1ccc(N2CC3(CCNCC3)C2)nn1 |
| InChI | InChI=1S/C22H26FN5O.C22H30N6.C21H27N5OS.C20H27FN4O.C20H22N6O.2C20H23N5O2/c1-21(2)10-16(11-22(3,4)28-21)29-20-8-7-19(26-27-20)17-6-5-14(9-18(17)23)15-12-24-25-13-15;1-21(2)12-17(13-22(3,4)26-21)28(6)20-10-9-18(23-24-20)15-7-8-19-16(11-15)14-27(5)25-19;1-20(2)9-16(10-21(3,4)25-20)27-19-7-6-17(23-24-19)18-8-14(13-28-18)15-11-22-26(5)12-15;1-19(2)11-13(12-20(3,4)24-19)25(5)18-9-8-17(22-23-18)15-7-6-14(26)10-16(15)21;27-18-9-14(15-10-22-23-11-15)1-2-16(18)17-3-4-19(25-24-17)26-12-20(13-26)5-7-21-8-6-20;1-13-10-16(11-14(2)22-13)27-20-7-6-18(23-24-20)17-5-4-15(12-19(17)26)25-9-3-8-21-25;1-12-7-16(8-13(2)23-12)27-20-6-5-18(24-25-20)17-4-3-14(9-19(17)26)15-10-21-22-11-15/h5-9,12-13,16,28H,10-11H2,1-4H3,(H,24,25);7-11,14,17,26H,12-13H2,1-6H3;6-8,11-13,16,25H,9-10H2,1-5H3;6-10,13,24,26H,11-12H2,1-5H3;1-4,9-11,21,27H,5-8,12-13H2,(H,22,23);3-9,12-14,16,22,26H,10-11H2,1-2H3;3-6,9-13,16,23,26H,7-8H2,1-2H3,(H,21,22) |
| InChIKey | MHQJDOGRBLONAX-UHFFFAOYSA-N |
| XLogP | 24.68 |
| TPSA | 531.73 Ų |
| H-Bond Donors | 14 |
| H-Bond Acceptors | 42 |
| Rotatable Bonds | 25 |
| Heavy Atoms | 192 |
| Complexity | — |
Lipinski Rule of Five
4 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2623.33 |
| LogP ≤ 5 | 24.68 |
| H-Bond Donors ≤ 5 | 14 |
| H-Bond Acceptors ≤ 10 | 42 |
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Sources
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