C75H78Cl4F3N17O7S — CID 157448915
8-(6-chloro-1H-indazol-4-yl)-1-methyl-1,8-diazaspiro[4.5]decan-2-one;N-[4-(6-chloro-1H-indazol-4-yl)phenyl]acetamide;N-[4-(6-chloro-1H-indazol-4-yl)phenyl]-N-methylacetamide;1-[1-(6-chloro-1H-indazol-4-yl)piperidin-4-yl]propan-1-one;4-(4-methylsulfonylpiperazin-1-yl)-6-(trifluoromethoxy)-1H-indazole (PubChem CID 157448915) has the molecular formula C75H78Cl4F3N17O7S and a molecular weight of 1560.43 g/mol. Its IUPAC name is 8-(6-chloro-1H-indazol-4-yl)-1-methyl-1,8-diazaspiro[4.5]decan-2-one;N-[4-(6-chloro-1H-indazol-4-yl)phenyl]acetamide;N-[4-(6-chloro-1H-indazol-4-yl)phenyl]-N-methylacetamide;1-[1-(6-chloro-1H-indazol-4-yl)piperidin-4-yl]propan-1-one;4-(4-methylsulfonylpiperazin-1-yl)-6-(trifluoromethoxy)-1H-indazole.
| Compound Name | 8-(6-chloro-1H-indazol-4-yl)-1-methyl-1,8-diazaspiro[4.5]decan-2-one;N-[4-(6-chloro-1H-indazol-4-yl)phenyl]acetamide;N-[4-(6-chloro-1H-indazol-4-yl)phenyl]-N-methylacetamide;1-[1-(6-chloro-1H-indazol-4-yl)piperidin-4-yl]propan-1-one;4-(4-methylsulfonylpiperazin-1-yl)-6-(trifluoromethoxy)-1H-indazole |
|---|---|
| PubChem CID | 157448915 |
| Molecular Formula | C75H78Cl4F3N17O7S |
| Molecular Weight | 1560.43 g/mol |
| Exact Mass | 1557.47 |
| IUPAC Name | 8-(6-chloro-1H-indazol-4-yl)-1-methyl-1,8-diazaspiro[4.5]decan-2-one;N-[4-(6-chloro-1H-indazol-4-yl)phenyl]acetamide;N-[4-(6-chloro-1H-indazol-4-yl)phenyl]-N-methylacetamide;1-[1-(6-chloro-1H-indazol-4-yl)piperidin-4-yl]propan-1-one;4-(4-methylsulfonylpiperazin-1-yl)-6-(trifluoromethoxy)-1H-indazole |
| SMILES | CC(=O)N(C)c1ccc(-c2cc(Cl)cc3[nH]ncc23)cc1.CC(=O)Nc1ccc(-c2cc(Cl)cc3[nH]ncc23)cc1.CCC(=O)C1CCN(c2cc(Cl)cc3[nH]ncc23)CC1.CN1C(=O)CCC12CCN(c1cc(Cl)cc3[nH]ncc13)CC2.CS(=O)(=O)N1CCN(c2cc(OC(F)(F)F)cc3[nH]ncc23)CC1 |
| InChI | InChI=1S/C16H19ClN4O.C16H14ClN3O.C15H12ClN3O.C15H18ClN3O.C13H15F3N4O3S/c1-20-15(22)2-3-16(20)4-6-21(7-5-16)14-9-11(17)8-13-12(14)10-18-19-13;1-10(21)20(2)13-5-3-11(4-6-13)14-7-12(17)8-16-15(14)9-18-19-16;1-9(20)18-12-4-2-10(3-5-12)13-6-11(16)7-15-14(13)8-17-19-15;1-2-15(20)10-3-5-19(6-4-10)14-8-11(16)7-13-12(14)9-17-18-13;1-24(21,22)20-4-2-19(3-5-20)12-7-9(23-13(14,15)16)6-11-10(12)8-17-18-11/h8-10H,2-7H2,1H3,(H,18,19);3-9H,1-2H3,(H,18,19);2-8H,1H3,(H,17,19)(H,18,20);7-10H,2-6H2,1H3,(H,17,18);6-8H,2-5H2,1H3,(H,17,18) |
| InChIKey | BSOFHPFJKHQBIR-UHFFFAOYSA-N |
| XLogP | 15.47 |
| TPSA | 286.52 Ų |
| H-Bond Donors | 6 |
| H-Bond Acceptors | 15 |
| Rotatable Bonds | 11 |
| Heavy Atoms | 107 |
| Complexity | — |
4 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 1560.43 |
| LogP ≤ 5 | 15.47 |
| H-Bond Donors ≤ 5 | 6 |
| H-Bond Acceptors ≤ 10 | 15 |