C154H138Cl2F5N19O9 — CID 163925082
2-(3-chlorophenyl)-5-methyl-4-phenyl-1H-imidazole;2-(4-chlorophenyl)-5-methyl-4-phenyl-1H-imidazole;4-[3-(1,1-difluoroethyl)phenyl]-5-methyl-2-phenyl-1H-imidazole;2-(hydroxymethyl)-5-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenol;5-(hydroxymethyl)-2-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenol;[3-(hydroxymethyl)-4-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenyl]methanol;2-hydroxy-N-[4-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenyl]acetamide;[4-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenyl]methanol;5-methyl-4-phenyl-2-[3-(trifluoromethyl)phenyl]-1H-imidazole (PubChem CID 163925082) has the molecular formula C154H138Cl2F5N19O9 and a molecular weight of 2564.82 g/mol. Its IUPAC name is 2-(3-chlorophenyl)-5-methyl-4-phenyl-1H-imidazole;2-(4-chlorophenyl)-5-methyl-4-phenyl-1H-imidazole;4-[3-(1,1-difluoroethyl)phenyl]-5-methyl-2-phenyl-1H-imidazole;2-(hydroxymethyl)-5-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenol;5-(hydroxymethyl)-2-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenol;[3-(hydroxymethyl)-4-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenyl]methanol;2-hydroxy-N-[4-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenyl]acetamide;[4-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenyl]methanol;5-methyl-4-phenyl-2-[3-(trifluoromethyl)phenyl]-1H-imidazole.
| Compound Name | 2-(3-chlorophenyl)-5-methyl-4-phenyl-1H-imidazole;2-(4-chlorophenyl)-5-methyl-4-phenyl-1H-imidazole;4-[3-(1,1-difluoroethyl)phenyl]-5-methyl-2-phenyl-1H-imidazole;2-(hydroxymethyl)-5-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenol;5-(hydroxymethyl)-2-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenol;[3-(hydroxymethyl)-4-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenyl]methanol;2-hydroxy-N-[4-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenyl]acetamide;[4-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenyl]methanol;5-methyl-4-phenyl-2-[3-(trifluoromethyl)phenyl]-1H-imidazole |
|---|---|
| PubChem CID | 163925082 |
| Molecular Formula | C154H138Cl2F5N19O9 |
| Molecular Weight | 2564.82 g/mol |
| Exact Mass | 2562.02 |
| IUPAC Name | 2-(3-chlorophenyl)-5-methyl-4-phenyl-1H-imidazole;2-(4-chlorophenyl)-5-methyl-4-phenyl-1H-imidazole;4-[3-(1,1-difluoroethyl)phenyl]-5-methyl-2-phenyl-1H-imidazole;2-(hydroxymethyl)-5-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenol;5-(hydroxymethyl)-2-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenol;[3-(hydroxymethyl)-4-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenyl]methanol;2-hydroxy-N-[4-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenyl]acetamide;[4-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenyl]methanol;5-methyl-4-phenyl-2-[3-(trifluoromethyl)phenyl]-1H-imidazole |
| SMILES | Cc1[nH]c(-c2ccc(CO)c(O)c2)nc1-c1ccccc1.Cc1[nH]c(-c2ccc(CO)cc2)nc1-c1ccccc1.Cc1[nH]c(-c2ccc(CO)cc2CO)nc1-c1ccccc1.Cc1[nH]c(-c2ccc(CO)cc2O)nc1-c1ccccc1.Cc1[nH]c(-c2ccc(Cl)cc2)nc1-c1ccccc1.Cc1[nH]c(-c2ccc(NC(=O)CO)cc2)nc1-c1ccccc1.Cc1[nH]c(-c2cccc(C(F)(F)F)c2)nc1-c1ccccc1.Cc1[nH]c(-c2cccc(Cl)c2)nc1-c1ccccc1.Cc1[nH]c(-c2ccccc2)nc1-c1cccc(C(C)(F)F)c1 |
| InChI | InChI=1S/C18H16F2N2.C18H17N3O2.C18H18N2O2.C17H13F3N2.2C17H16N2O2.C17H16N2O.2C16H13ClN2/c1-12-16(14-9-6-10-15(11-14)18(2,19)20)22-17(21-12)13-7-4-3-5-8-13;1-12-17(13-5-3-2-4-6-13)21-18(19-12)14-7-9-15(10-8-14)20-16(23)11-22;1-12-17(14-5-3-2-4-6-14)20-18(19-12)16-8-7-13(10-21)9-15(16)11-22;1-11-15(12-6-3-2-4-7-12)22-16(21-11)13-8-5-9-14(10-13)17(18,19)20;1-11-16(13-5-3-2-4-6-13)19-17(18-11)14-8-7-12(10-20)9-15(14)21;1-11-16(12-5-3-2-4-6-12)19-17(18-11)13-7-8-14(10-20)15(21)9-13;1-12-16(14-5-3-2-4-6-14)19-17(18-12)15-9-7-13(11-20)8-10-15;1-11-15(12-6-3-2-4-7-12)19-16(18-11)13-8-5-9-14(17)10-13;1-11-15(12-5-3-2-4-6-12)19-16(18-11)13-7-9-14(17)10-8-13/h3-11H,1-2H3,(H,21,22);2-10,22H,11H2,1H3,(H,19,21)(H,20,23);2-9,21-22H,10-11H2,1H3,(H,19,20);2-10H,1H3,(H,21,22);2*2-9,20-21H,10H2,1H3,(H,18,19);2-10,20H,11H2,1H3,(H,18,19);2*2-10H,1H3,(H,18,19) |
| InChIKey | RDTDDFVJUMJFMA-UHFFFAOYSA-N |
| XLogP | 35.71 |
| TPSA | 449.06 Ų |
| H-Bond Donors | 18 |
| H-Bond Acceptors | 18 |
| Rotatable Bonds | 26 |
| Heavy Atoms | 189 |
| Complexity | — |
4 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2564.82 |
| LogP ≤ 5 | 35.71 |
| H-Bond Donors ≤ 5 | 18 |
| H-Bond Acceptors ≤ 10 | 18 |