C98H71ClF15N17O7 — CID 162265663
4-chloro-N-methyl-1-[[4-(trifluoromethyl)phenyl]methyl]pyrazolo[3,4-c]pyridin-3-amine;N-[5-cyano-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indazol-3-yl]furan-3-carboxamide;2-methoxy-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]benzamide;3-(2-methylfuran-3-yl)-1-[[4-(trifluoromethyl)phenyl]methyl]indazole;N-[1-[[3-(trifluoromethyl)phenyl]methyl]indazol-3-yl]furan-3-carboxamide (PubChem CID 162265663) has the molecular formula C98H71ClF15N17O7 and a molecular weight of 1919.18 g/mol. Its IUPAC name is 4-chloro-N-methyl-1-[[4-(trifluoromethyl)phenyl]methyl]pyrazolo[3,4-c]pyridin-3-amine;N-[5-cyano-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indazol-3-yl]furan-3-carboxamide;2-methoxy-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]benzamide;3-(2-methylfuran-3-yl)-1-[[4-(trifluoromethyl)phenyl]methyl]indazole;N-[1-[[3-(trifluoromethyl)phenyl]methyl]indazol-3-yl]furan-3-carboxamide.
| Compound Name | 4-chloro-N-methyl-1-[[4-(trifluoromethyl)phenyl]methyl]pyrazolo[3,4-c]pyridin-3-amine;N-[5-cyano-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indazol-3-yl]furan-3-carboxamide;2-methoxy-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]benzamide;3-(2-methylfuran-3-yl)-1-[[4-(trifluoromethyl)phenyl]methyl]indazole;N-[1-[[3-(trifluoromethyl)phenyl]methyl]indazol-3-yl]furan-3-carboxamide |
|---|---|
| PubChem CID | 162265663 |
| Molecular Formula | C98H71ClF15N17O7 |
| Molecular Weight | 1919.18 g/mol |
| Exact Mass | 1917.52 |
| IUPAC Name | 4-chloro-N-methyl-1-[[4-(trifluoromethyl)phenyl]methyl]pyrazolo[3,4-c]pyridin-3-amine;N-[5-cyano-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indazol-3-yl]furan-3-carboxamide;2-methoxy-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]benzamide;3-(2-methylfuran-3-yl)-1-[[4-(trifluoromethyl)phenyl]methyl]indazole;N-[1-[[3-(trifluoromethyl)phenyl]methyl]indazol-3-yl]furan-3-carboxamide |
| SMILES | CNc1nn(Cc2ccc(C(F)(F)F)cc2)c2cncc(Cl)c12.COc1ccccc1C(=O)Nc1nn(Cc2ccc(C(F)(F)F)cc2)c2ccccc12.Cc1occc1-c1nn(Cc2ccc(C(F)(F)F)cc2)c2ccccc12.N#Cc1ccc2c(c1)c(NC(=O)c1ccoc1)nn2Cc1ccc(C(F)(F)F)nc1.O=C(Nc1nn(Cc2cccc(C(F)(F)F)c2)c2ccccc12)c1ccoc1 |
| InChI | InChI=1S/C23H18F3N3O2.C20H12F3N5O2.C20H14F3N3O2.C20H15F3N2O.C15H12ClF3N4/c1-31-20-9-5-3-7-18(20)22(30)27-21-17-6-2-4-8-19(17)29(28-21)14-15-10-12-16(13-11-15)23(24,25)26;21-20(22,23)17-4-2-13(9-25-17)10-28-16-3-1-12(8-24)7-15(16)18(27-28)26-19(29)14-5-6-30-11-14;21-20(22,23)15-5-3-4-13(10-15)11-26-17-7-2-1-6-16(17)18(25-26)24-19(27)14-8-9-28-12-14;1-13-16(10-11-26-13)19-17-4-2-3-5-18(17)25(24-19)12-14-6-8-15(9-7-14)20(21,22)23;1-20-14-13-11(16)6-21-7-12(13)23(22-14)8-9-2-4-10(5-3-9)15(17,18)19/h2-13H,14H2,1H3,(H,27,28,30);1-7,9,11H,10H2,(H,26,27,29);1-10,12H,11H2,(H,24,25,27);2-11H,12H2,1H3;2-7H,8H2,1H3,(H,20,22) |
| InChIKey | ZZWGZEBQHXSMEG-UHFFFAOYSA-N |
| XLogP | 24.39 |
| TPSA | 286.65 Ų |
| H-Bond Donors | 4 |
| H-Bond Acceptors | 21 |
| Rotatable Bonds | 19 |
| Heavy Atoms | 138 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 1919.18 |
| LogP ≤ 5 | 24.39 |
| H-Bond Donors ≤ 5 | 4 |
| H-Bond Acceptors ≤ 10 | 21 |