C170H166N26O11 — CID 158943741
2-[5-benzyl-3-(3H-inden-4-ylmethyl)imidazol-4-yl]acetamide;2-[5-benzyl-3-(1H-indol-6-ylmethyl)imidazol-4-yl]acetamide;2-[5-benzyl-3-[(2-oxo-1,3-dihydroindol-4-yl)methyl]imidazol-4-yl]acetamide;2-[5-benzyl-3-[(2-oxo-1,3-dihydroindol-5-yl)methyl]imidazol-4-yl]acetamide;4-[[5-(2-hydroxypropyl)-4-phenylimidazol-1-yl]methyl]-1,3-dihydroindol-2-one;1-[3-(3H-inden-5-ylmethyl)-5-phenylimidazol-4-yl]propan-2-ol;1-[3-(1H-indol-5-ylmethyl)-5-phenylimidazol-4-yl]propan-2-ol;1-[3-(1H-indol-7-ylmethyl)-5-phenylimidazol-4-yl]propan-2-ol (PubChem CID 158943741) has the molecular formula C170H166N26O11 and a molecular weight of 2749.37 g/mol. Its IUPAC name is 2-[5-benzyl-3-(3H-inden-4-ylmethyl)imidazol-4-yl]acetamide;2-[5-benzyl-3-(1H-indol-6-ylmethyl)imidazol-4-yl]acetamide;2-[5-benzyl-3-[(2-oxo-1,3-dihydroindol-4-yl)methyl]imidazol-4-yl]acetamide;2-[5-benzyl-3-[(2-oxo-1,3-dihydroindol-5-yl)methyl]imidazol-4-yl]acetamide;4-[[5-(2-hydroxypropyl)-4-phenylimidazol-1-yl]methyl]-1,3-dihydroindol-2-one;1-[3-(3H-inden-5-ylmethyl)-5-phenylimidazol-4-yl]propan-2-ol;1-[3-(1H-indol-5-ylmethyl)-5-phenylimidazol-4-yl]propan-2-ol;1-[3-(1H-indol-7-ylmethyl)-5-phenylimidazol-4-yl]propan-2-ol.
| Compound Name | 2-[5-benzyl-3-(3H-inden-4-ylmethyl)imidazol-4-yl]acetamide;2-[5-benzyl-3-(1H-indol-6-ylmethyl)imidazol-4-yl]acetamide;2-[5-benzyl-3-[(2-oxo-1,3-dihydroindol-4-yl)methyl]imidazol-4-yl]acetamide;2-[5-benzyl-3-[(2-oxo-1,3-dihydroindol-5-yl)methyl]imidazol-4-yl]acetamide;4-[[5-(2-hydroxypropyl)-4-phenylimidazol-1-yl]methyl]-1,3-dihydroindol-2-one;1-[3-(3H-inden-5-ylmethyl)-5-phenylimidazol-4-yl]propan-2-ol;1-[3-(1H-indol-5-ylmethyl)-5-phenylimidazol-4-yl]propan-2-ol;1-[3-(1H-indol-7-ylmethyl)-5-phenylimidazol-4-yl]propan-2-ol |
|---|---|
| PubChem CID | 158943741 |
| Molecular Formula | C170H166N26O11 |
| Molecular Weight | 2749.37 g/mol |
| Exact Mass | 2747.32 |
| IUPAC Name | 2-[5-benzyl-3-(3H-inden-4-ylmethyl)imidazol-4-yl]acetamide;2-[5-benzyl-3-(1H-indol-6-ylmethyl)imidazol-4-yl]acetamide;2-[5-benzyl-3-[(2-oxo-1,3-dihydroindol-4-yl)methyl]imidazol-4-yl]acetamide;2-[5-benzyl-3-[(2-oxo-1,3-dihydroindol-5-yl)methyl]imidazol-4-yl]acetamide;4-[[5-(2-hydroxypropyl)-4-phenylimidazol-1-yl]methyl]-1,3-dihydroindol-2-one;1-[3-(3H-inden-5-ylmethyl)-5-phenylimidazol-4-yl]propan-2-ol;1-[3-(1H-indol-5-ylmethyl)-5-phenylimidazol-4-yl]propan-2-ol;1-[3-(1H-indol-7-ylmethyl)-5-phenylimidazol-4-yl]propan-2-ol |
| SMILES | CC(O)Cc1c(-c2ccccc2)ncn1Cc1ccc2[nH]ccc2c1.CC(O)Cc1c(-c2ccccc2)ncn1Cc1ccc2c(c1)CC=C2.CC(O)Cc1c(-c2ccccc2)ncn1Cc1cccc2c1CC(=O)N2.CC(O)Cc1c(-c2ccccc2)ncn1Cc1cccc2cc[nH]c12.NC(=O)Cc1c(Cc2ccccc2)ncn1Cc1ccc2c(c1)CC(=O)N2.NC(=O)Cc1c(Cc2ccccc2)ncn1Cc1ccc2cc[nH]c2c1.NC(=O)Cc1c(Cc2ccccc2)ncn1Cc1cccc2c1CC(=O)N2.NC(=O)Cc1c(Cc2ccccc2)ncn1Cc1cccc2c1CC=C2 |
| InChI | InChI=1S/C22H21N3O.C22H22N2O.2C21H20N4O2.C21H20N4O.C21H21N3O2.2C21H21N3O/c23-22(26)13-21-20(12-16-6-2-1-3-7-16)24-15-25(21)14-18-10-4-8-17-9-5-11-19(17)18;1-16(25)12-21-22(19-6-3-2-4-7-19)23-15-24(21)14-17-10-11-18-8-5-9-20(18)13-17;22-20(26)11-19-18(9-14-5-2-1-3-6-14)23-13-25(19)12-15-7-4-8-17-16(15)10-21(27)24-17;22-20(26)11-19-18(9-14-4-2-1-3-5-14)23-13-25(19)12-15-6-7-17-16(8-15)10-21(27)24-17;22-21(26)12-20-19(10-15-4-2-1-3-5-15)24-14-25(20)13-16-6-7-17-8-9-23-18(17)11-16;1-14(25)10-19-21(15-6-3-2-4-7-15)22-13-24(19)12-16-8-5-9-18-17(16)11-20(26)23-18;1-15(25)12-19-21(16-6-3-2-4-7-16)23-14-24(19)13-18-9-5-8-17-10-11-22-20(17)18;1-15(25)11-20-21(17-5-3-2-4-6-17)23-14-24(20)13-16-7-8-19-18(12-16)9-10-22-19/h1-10,15H,11-14H2,(H2,23,26);2-8,10-11,13,15-16,25H,9,12,14H2,1H3;2*1-8,13H,9-12H2,(H2,22,26)(H,24,27);1-9,11,14,23H,10,12-13H2,(H2,22,26);2-9,13-14,25H,10-12H2,1H3,(H,23,26);2-11,14-15,22,25H,12-13H2,1H3;2-10,12,14-15,22,25H,11,13H2,1H3 |
| InChIKey | JKOLJUDFBOOIDA-UHFFFAOYSA-N |
| XLogP | 25.35 |
| TPSA | 530.51 Ų |
| H-Bond Donors | 14 |
| H-Bond Acceptors | 27 |
| Rotatable Bonds | 44 |
| Heavy Atoms | 207 |
| Complexity | — |
4 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2749.37 |
| LogP ≤ 5 | 25.35 |
| H-Bond Donors ≤ 5 | 14 |
| H-Bond Acceptors ≤ 10 | 27 |