C123H90Cl5F12N23O7S2 — CID 158237753
N-[1-[(4-chlorophenyl)methyl]indazol-3-yl]-4-methyl-1,3-thiazole-5-carboxamide;N-[1-[(4-chlorophenyl)methyl]indazol-3-yl]pyridazine-3-carboxamide;N-[4-chloro-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-2-methylfuran-3-carboxamide;N-[4-chloro-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-4-methyl-1,3-thiazole-5-carboxamide;4-chloro-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]pyridine-2-carboxamide;3-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]benzamide (PubChem CID 158237753) has the molecular formula C123H90Cl5F12N23O7S2 and a molecular weight of 2471.60 g/mol. Its IUPAC name is N-[1-[(4-chlorophenyl)methyl]indazol-3-yl]-4-methyl-1,3-thiazole-5-carboxamide;N-[1-[(4-chlorophenyl)methyl]indazol-3-yl]pyridazine-3-carboxamide;N-[4-chloro-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-2-methylfuran-3-carboxamide;N-[4-chloro-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-4-methyl-1,3-thiazole-5-carboxamide;4-chloro-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]pyridine-2-carboxamide;3-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]benzamide.
| Compound Name | N-[1-[(4-chlorophenyl)methyl]indazol-3-yl]-4-methyl-1,3-thiazole-5-carboxamide;N-[1-[(4-chlorophenyl)methyl]indazol-3-yl]pyridazine-3-carboxamide;N-[4-chloro-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-2-methylfuran-3-carboxamide;N-[4-chloro-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-4-methyl-1,3-thiazole-5-carboxamide;4-chloro-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]pyridine-2-carboxamide;3-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]benzamide |
|---|---|
| PubChem CID | 158237753 |
| Molecular Formula | C123H90Cl5F12N23O7S2 |
| Molecular Weight | 2471.60 g/mol |
| Exact Mass | 2467.51 |
| IUPAC Name | N-[1-[(4-chlorophenyl)methyl]indazol-3-yl]-4-methyl-1,3-thiazole-5-carboxamide;N-[1-[(4-chlorophenyl)methyl]indazol-3-yl]pyridazine-3-carboxamide;N-[4-chloro-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-2-methylfuran-3-carboxamide;N-[4-chloro-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-4-methyl-1,3-thiazole-5-carboxamide;4-chloro-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]pyridine-2-carboxamide;3-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]benzamide |
| SMILES | Cc1cccc(C(=O)Nc2nn(Cc3ccc(C(F)(F)F)cc3)c3ccccc23)c1.Cc1ncsc1C(=O)Nc1nn(Cc2ccc(C(F)(F)F)cc2)c2cccc(Cl)c12.Cc1ncsc1C(=O)Nc1nn(Cc2ccc(Cl)cc2)c2ccccc12.Cc1occc1C(=O)Nc1nn(Cc2ccc(C(F)(F)F)cc2)c2cccc(Cl)c12.O=C(Nc1nn(Cc2ccc(C(F)(F)F)cc2)c2ccccc12)c1cc(Cl)ccn1.O=C(Nc1nn(Cc2ccc(Cl)cc2)c2ccccc12)c1cccnn1 |
| InChI | InChI=1S/C23H18F3N3O.C21H14ClF3N4O.C21H15ClF3N3O2.C20H14ClF3N4OS.C19H14ClN5O.C19H15ClN4OS/c1-15-5-4-6-17(13-15)22(30)27-21-19-7-2-3-8-20(19)29(28-21)14-16-9-11-18(12-10-16)23(24,25)26;22-15-9-10-26-17(11-15)20(30)27-19-16-3-1-2-4-18(16)29(28-19)12-13-5-7-14(8-6-13)21(23,24)25;1-12-15(9-10-30-12)20(29)26-19-18-16(22)3-2-4-17(18)28(27-19)11-13-5-7-14(8-6-13)21(23,24)25;1-11-17(30-10-25-11)19(29)26-18-16-14(21)3-2-4-15(16)28(27-18)9-12-5-7-13(8-6-12)20(22,23)24;20-14-9-7-13(8-10-14)12-25-17-6-2-1-4-15(17)18(24-25)22-19(26)16-5-3-11-21-23-16;1-12-17(26-11-21-12)19(25)22-18-15-4-2-3-5-16(15)24(23-18)10-13-6-8-14(20)9-7-13/h2-13H,14H2,1H3,(H,27,28,30);1-11H,12H2,(H,27,28,30);2-10H,11H2,1H3,(H,26,27,29);2-8,10H,9H2,1H3,(H,26,27,29);1-11H,12H2,(H,22,24,26);2-9,11H,10H2,1H3,(H,22,23,25) |
| InChIKey | GFEFPFSVQIQMMN-UHFFFAOYSA-N |
| XLogP | 31.29 |
| TPSA | 359.11 Ų |
| H-Bond Donors | 6 |
| H-Bond Acceptors | 26 |
| Rotatable Bonds | 24 |
| Heavy Atoms | 172 |
| Complexity | — |
4 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2471.60 |
| LogP ≤ 5 | 31.29 |
| H-Bond Donors ≤ 5 | 6 |
| H-Bond Acceptors ≤ 10 | 26 |