C217H194N44O15 — CID 159996159
1-methyl-N-[4-[5-[(1-methylindole-5-carbonyl)amino]indazol-1-yl]phenyl]indole-5-carboxamide;5-methyl-N-[4-[5-[[4-(4-methylpiperidin-1-yl)benzoyl]amino]indazol-1-yl]phenyl]-1,2-oxazole-3-carboxamide;6-methyl-N-[4-[5-[[4-(4-methylpiperidin-1-yl)benzoyl]amino]indazol-1-yl]phenyl]pyridine-2-carboxamide;N-[4-[5-[[4-(4-methylpiperidin-1-yl)benzoyl]amino]indazol-1-yl]phenyl]pyridazine-4-carboxamide;N-[4-[5-[[4-(4-methylpiperidin-1-yl)benzoyl]amino]indazol-1-yl]phenyl]pyrimidine-4-carboxamide;1-methyl-N-[1-[4-(1H-pyrrole-2-carbonylamino)phenyl]indazol-5-yl]indole-5-carboxamide;1-propyl-N-[1-[4-(1H-pyrrole-2-carbonylamino)phenyl]indazol-5-yl]indole-5-carboxamide (PubChem CID 159996159) has the molecular formula C217H194N44O15 and a molecular weight of 3658.23 g/mol. Its IUPAC name is 1-methyl-N-[4-[5-[(1-methylindole-5-carbonyl)amino]indazol-1-yl]phenyl]indole-5-carboxamide;5-methyl-N-[4-[5-[[4-(4-methylpiperidin-1-yl)benzoyl]amino]indazol-1-yl]phenyl]-1,2-oxazole-3-carboxamide;6-methyl-N-[4-[5-[[4-(4-methylpiperidin-1-yl)benzoyl]amino]indazol-1-yl]phenyl]pyridine-2-carboxamide;N-[4-[5-[[4-(4-methylpiperidin-1-yl)benzoyl]amino]indazol-1-yl]phenyl]pyridazine-4-carboxamide;N-[4-[5-[[4-(4-methylpiperidin-1-yl)benzoyl]amino]indazol-1-yl]phenyl]pyrimidine-4-carboxamide;1-methyl-N-[1-[4-(1H-pyrrole-2-carbonylamino)phenyl]indazol-5-yl]indole-5-carboxamide;1-propyl-N-[1-[4-(1H-pyrrole-2-carbonylamino)phenyl]indazol-5-yl]indole-5-carboxamide.
| Compound Name | 1-methyl-N-[4-[5-[(1-methylindole-5-carbonyl)amino]indazol-1-yl]phenyl]indole-5-carboxamide;5-methyl-N-[4-[5-[[4-(4-methylpiperidin-1-yl)benzoyl]amino]indazol-1-yl]phenyl]-1,2-oxazole-3-carboxamide;6-methyl-N-[4-[5-[[4-(4-methylpiperidin-1-yl)benzoyl]amino]indazol-1-yl]phenyl]pyridine-2-carboxamide;N-[4-[5-[[4-(4-methylpiperidin-1-yl)benzoyl]amino]indazol-1-yl]phenyl]pyridazine-4-carboxamide;N-[4-[5-[[4-(4-methylpiperidin-1-yl)benzoyl]amino]indazol-1-yl]phenyl]pyrimidine-4-carboxamide;1-methyl-N-[1-[4-(1H-pyrrole-2-carbonylamino)phenyl]indazol-5-yl]indole-5-carboxamide;1-propyl-N-[1-[4-(1H-pyrrole-2-carbonylamino)phenyl]indazol-5-yl]indole-5-carboxamide |
|---|---|
| PubChem CID | 159996159 |
| Molecular Formula | C217H194N44O15 |
| Molecular Weight | 3658.23 g/mol |
| Exact Mass | 3655.58 |
| IUPAC Name | 1-methyl-N-[4-[5-[(1-methylindole-5-carbonyl)amino]indazol-1-yl]phenyl]indole-5-carboxamide;5-methyl-N-[4-[5-[[4-(4-methylpiperidin-1-yl)benzoyl]amino]indazol-1-yl]phenyl]-1,2-oxazole-3-carboxamide;6-methyl-N-[4-[5-[[4-(4-methylpiperidin-1-yl)benzoyl]amino]indazol-1-yl]phenyl]pyridine-2-carboxamide;N-[4-[5-[[4-(4-methylpiperidin-1-yl)benzoyl]amino]indazol-1-yl]phenyl]pyridazine-4-carboxamide;N-[4-[5-[[4-(4-methylpiperidin-1-yl)benzoyl]amino]indazol-1-yl]phenyl]pyrimidine-4-carboxamide;1-methyl-N-[1-[4-(1H-pyrrole-2-carbonylamino)phenyl]indazol-5-yl]indole-5-carboxamide;1-propyl-N-[1-[4-(1H-pyrrole-2-carbonylamino)phenyl]indazol-5-yl]indole-5-carboxamide |
| SMILES | CC1CCN(c2ccc(C(=O)Nc3ccc4c(cnn4-c4ccc(NC(=O)c5ccncn5)cc4)c3)cc2)CC1.CC1CCN(c2ccc(C(=O)Nc3ccc4c(cnn4-c4ccc(NC(=O)c5ccnnc5)cc4)c3)cc2)CC1.CCCn1ccc2cc(C(=O)Nc3ccc4c(cnn4-c4ccc(NC(=O)c5ccc[nH]5)cc4)c3)ccc21.Cc1cc(C(=O)Nc2ccc(-n3ncc4cc(NC(=O)c5ccc(N6CCC(C)CC6)cc5)ccc43)cc2)no1.Cc1cccc(C(=O)Nc2ccc(-n3ncc4cc(NC(=O)c5ccc(N6CCC(C)CC6)cc5)ccc43)cc2)n1.Cn1ccc2cc(C(=O)Nc3ccc(-n4ncc5cc(NC(=O)c6ccc7c(ccn7C)c6)ccc54)cc3)ccc21.Cn1ccc2cc(C(=O)Nc3ccc4c(cnn4-c4ccc(NC(=O)c5ccc[nH]5)cc4)c3)ccc21 |
| InChI | InChI=1S/C33H26N6O2.C33H32N6O2.2C31H29N7O2.C31H30N6O3.C30H26N6O2.C28H22N6O2/c1-37-15-13-21-17-23(3-10-29(21)37)32(40)35-26-5-8-28(9-6-26)39-31-12-7-27(19-25(31)20-34-39)36-33(41)24-4-11-30-22(18-24)14-16-38(30)2;1-22-16-18-38(19-17-22)28-11-6-24(7-12-28)32(40)37-27-10-15-31-25(20-27)21-34-39(31)29-13-8-26(9-14-29)36-33(41)30-5-3-4-23(2)35-30;1-21-13-16-37(17-14-21)26-7-2-22(3-8-26)30(39)36-25-6-11-29-23(18-25)19-34-38(29)27-9-4-24(5-10-27)35-31(40)28-12-15-32-20-33-28;1-21-13-16-37(17-14-21)27-7-2-22(3-8-27)30(39)36-26-6-11-29-24(18-26)20-34-38(29)28-9-4-25(5-10-28)35-31(40)23-12-15-32-33-19-23;1-20-13-15-36(16-14-20)26-8-3-22(4-9-26)30(38)34-25-7-12-29-23(18-25)19-32-37(29)27-10-5-24(6-11-27)33-31(39)28-17-21(2)40-35-28;1-2-15-35-16-13-20-17-21(5-11-27(20)35)29(37)34-24-8-12-28-22(18-24)19-32-36(28)25-9-6-23(7-10-25)33-30(38)26-4-3-14-31-26;1-33-14-12-18-15-19(4-10-25(18)33)27(35)32-22-7-11-26-20(16-22)17-30-34(26)23-8-5-21(6-9-23)31-28(36)24-3-2-13-29-24/h3-20H,1-2H3,(H,35,40)(H,36,41);3-15,20-22H,16-19H2,1-2H3,(H,36,41)(H,37,40);2*2-12,15,18-21H,13-14,16-17H2,1H3,(H,35,40)(H,36,39);3-12,17-20H,13-16H2,1-2H3,(H,33,39)(H,34,38);3-14,16-19,31H,2,15H2,1H3,(H,33,38)(H,34,37);2-17,29H,1H3,(H,31,36)(H,32,35) |
| InChIKey | OHOJXNBHONJGBF-UHFFFAOYSA-N |
| XLogP | 41.73 |
| TPSA | 686.88 Ų |
| H-Bond Donors | 16 |
| H-Bond Acceptors | 43 |
| Rotatable Bonds | 41 |
| Heavy Atoms | 276 |
| Complexity | — |
4 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 3658.23 |
| LogP ≤ 5 | 41.73 |
| H-Bond Donors ≤ 5 | 16 |
| H-Bond Acceptors ≤ 10 | 43 |