C207H176F2N26O18S — CID 158531010
N-(1-benzylindol-3-yl)furan-3-carboxamide;N-[1-[(4-fluorophenyl)methyl]indol-3-yl]furan-3-carboxamide;N-[1-[(4-fluorophenyl)methyl]indol-3-yl]-3-methyl-1,2-oxazole-4-carboxamide;2-methyl-N-[1-[(4-methylphenyl)methyl]indol-3-yl]furan-3-carboxamide;3-methyl-N-[1-[(4-methylphenyl)methyl]indol-3-yl]-1,2-oxazole-4-carboxamide;4-methyl-N-[1-[(4-methylphenyl)methyl]indol-3-yl]-1,3-thiazole-5-carboxamide;N-[1-[(2-methylphenyl)methyl]indol-3-yl]furan-3-carboxamide;N-[1-[(4-methylphenyl)methyl]indol-3-yl]furan-3-carboxamide;N-[1-[(4-methylphenyl)methyl]indol-3-yl]-1,2-oxazole-5-carboxamide;N-[1-[(4-methylphenyl)methyl]indol-3-yl]pyridazine-3-carboxamide (PubChem CID 158531010) has the molecular formula C207H176F2N26O18S and a molecular weight of 3385.91 g/mol. Its IUPAC name is N-(1-benzylindol-3-yl)furan-3-carboxamide;N-[1-[(4-fluorophenyl)methyl]indol-3-yl]furan-3-carboxamide;N-[1-[(4-fluorophenyl)methyl]indol-3-yl]-3-methyl-1,2-oxazole-4-carboxamide;2-methyl-N-[1-[(4-methylphenyl)methyl]indol-3-yl]furan-3-carboxamide;3-methyl-N-[1-[(4-methylphenyl)methyl]indol-3-yl]-1,2-oxazole-4-carboxamide;4-methyl-N-[1-[(4-methylphenyl)methyl]indol-3-yl]-1,3-thiazole-5-carboxamide;N-[1-[(2-methylphenyl)methyl]indol-3-yl]furan-3-carboxamide;N-[1-[(4-methylphenyl)methyl]indol-3-yl]furan-3-carboxamide;N-[1-[(4-methylphenyl)methyl]indol-3-yl]-1,2-oxazole-5-carboxamide;N-[1-[(4-methylphenyl)methyl]indol-3-yl]pyridazine-3-carboxamide.
| Compound Name | N-(1-benzylindol-3-yl)furan-3-carboxamide;N-[1-[(4-fluorophenyl)methyl]indol-3-yl]furan-3-carboxamide;N-[1-[(4-fluorophenyl)methyl]indol-3-yl]-3-methyl-1,2-oxazole-4-carboxamide;2-methyl-N-[1-[(4-methylphenyl)methyl]indol-3-yl]furan-3-carboxamide;3-methyl-N-[1-[(4-methylphenyl)methyl]indol-3-yl]-1,2-oxazole-4-carboxamide;4-methyl-N-[1-[(4-methylphenyl)methyl]indol-3-yl]-1,3-thiazole-5-carboxamide;N-[1-[(2-methylphenyl)methyl]indol-3-yl]furan-3-carboxamide;N-[1-[(4-methylphenyl)methyl]indol-3-yl]furan-3-carboxamide;N-[1-[(4-methylphenyl)methyl]indol-3-yl]-1,2-oxazole-5-carboxamide;N-[1-[(4-methylphenyl)methyl]indol-3-yl]pyridazine-3-carboxamide |
|---|---|
| PubChem CID | 158531010 |
| Molecular Formula | C207H176F2N26O18S |
| Molecular Weight | 3385.91 g/mol |
| Exact Mass | 3383.33 |
| IUPAC Name | N-(1-benzylindol-3-yl)furan-3-carboxamide;N-[1-[(4-fluorophenyl)methyl]indol-3-yl]furan-3-carboxamide;N-[1-[(4-fluorophenyl)methyl]indol-3-yl]-3-methyl-1,2-oxazole-4-carboxamide;2-methyl-N-[1-[(4-methylphenyl)methyl]indol-3-yl]furan-3-carboxamide;3-methyl-N-[1-[(4-methylphenyl)methyl]indol-3-yl]-1,2-oxazole-4-carboxamide;4-methyl-N-[1-[(4-methylphenyl)methyl]indol-3-yl]-1,3-thiazole-5-carboxamide;N-[1-[(2-methylphenyl)methyl]indol-3-yl]furan-3-carboxamide;N-[1-[(4-methylphenyl)methyl]indol-3-yl]furan-3-carboxamide;N-[1-[(4-methylphenyl)methyl]indol-3-yl]-1,2-oxazole-5-carboxamide;N-[1-[(4-methylphenyl)methyl]indol-3-yl]pyridazine-3-carboxamide |
| SMILES | Cc1ccc(Cn2cc(NC(=O)c3cccnn3)c3ccccc32)cc1.Cc1ccc(Cn2cc(NC(=O)c3ccno3)c3ccccc32)cc1.Cc1ccc(Cn2cc(NC(=O)c3ccoc3)c3ccccc32)cc1.Cc1ccc(Cn2cc(NC(=O)c3ccoc3C)c3ccccc32)cc1.Cc1ccc(Cn2cc(NC(=O)c3conc3C)c3ccccc32)cc1.Cc1ccc(Cn2cc(NC(=O)c3scnc3C)c3ccccc32)cc1.Cc1ccccc1Cn1cc(NC(=O)c2ccoc2)c2ccccc21.Cc1nocc1C(=O)Nc1cn(Cc2ccc(F)cc2)c2ccccc12.O=C(Nc1cn(Cc2ccc(F)cc2)c2ccccc12)c1ccoc1.O=C(Nc1cn(Cc2ccccc2)c2ccccc12)c1ccoc1 |
| InChI | InChI=1S/C22H20N2O2.C21H18N4O.C21H19N3O2.C21H19N3OS.2C21H18N2O2.C20H16FN3O2.C20H15FN2O2.C20H17N3O2.C20H16N2O2/c1-15-7-9-17(10-8-15)13-24-14-20(19-5-3-4-6-21(19)24)23-22(25)18-11-12-26-16(18)2;1-15-8-10-16(11-9-15)13-25-14-19(17-5-2-3-7-20(17)25)23-21(26)18-6-4-12-22-24-18;1-14-7-9-16(10-8-14)11-24-12-19(17-5-3-4-6-20(17)24)22-21(25)18-13-26-23-15(18)2;1-14-7-9-16(10-8-14)11-24-12-18(17-5-3-4-6-19(17)24)23-21(25)20-15(2)22-13-26-20;1-15-6-2-3-7-16(15)12-23-13-19(18-8-4-5-9-20(18)23)22-21(24)17-10-11-25-14-17;1-15-6-8-16(9-7-15)12-23-13-19(18-4-2-3-5-20(18)23)22-21(24)17-10-11-25-14-17;1-13-17(12-26-23-13)20(25)22-18-11-24(19-5-3-2-4-16(18)19)10-14-6-8-15(21)9-7-14;21-16-7-5-14(6-8-16)11-23-12-18(17-3-1-2-4-19(17)23)22-20(24)15-9-10-25-13-15;1-14-6-8-15(9-7-14)12-23-13-17(16-4-2-3-5-18(16)23)22-20(24)19-10-11-21-25-19;23-20(16-10-11-24-14-16)21-18-13-22(12-15-6-2-1-3-7-15)19-9-5-4-8-17(18)19/h3-12,14H,13H2,1-2H3,(H,23,25);2-12,14H,13H2,1H3,(H,23,26);3-10,12-13H,11H2,1-2H3,(H,22,25);3-10,12-13H,11H2,1-2H3,(H,23,25);2*2-11,13-14H,12H2,1H3,(H,22,24);2-9,11-12H,10H2,1H3,(H,22,25);1-10,12-13H,11H2,(H,22,24);2-11,13H,12H2,1H3,(H,22,24);1-11,13-14H,12H2,(H,21,23) |
| InChIKey | HNJCPAGCAQIGQQ-UHFFFAOYSA-N |
| XLogP | 46.27 |
| TPSA | 522.76 Ų |
| H-Bond Donors | 10 |
| H-Bond Acceptors | 35 |
| Rotatable Bonds | 40 |
| Heavy Atoms | 254 |
| Complexity | — |
4 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 3385.91 |
| LogP ≤ 5 | 46.27 |
| H-Bond Donors ≤ 5 | 10 |
| H-Bond Acceptors ≤ 10 | 35 |