C152H134N40O7S — CID 159619002
1-[2,5-dimethyl-4-(2-methyl-4-pyridinyl)imidazol-1-yl]-3-(5-pyrazin-2-yl-2-pyridinyl)propan-2-one;1-[2-methyl-4-(2-methyl-4-pyridinyl)imidazol-1-yl]-3-(5-pyrazin-2-yl-2-pyridinyl)propan-2-one;1-[5-methyl-4-(2-methyl-4-pyridinyl)imidazol-1-yl]-3-(5-pyrazin-2-yl-2-pyridinyl)propan-2-one;1-[4-(2-methyl-4-pyridinyl)imidazol-1-yl]-3-(5-pyrazin-2-yl-2-pyridinyl)propan-2-one;1-[4-(2-methyl-4-pyridinyl)pyrazol-1-yl]-3-(5-pyrazin-2-yl-2-pyridinyl)propan-2-one;1-[4-(6-methyl-3-pyridinyl)pyrazol-1-yl]-3-(5-pyrazin-2-yl-2-pyridinyl)propan-2-one;1-[5-(2-methyl-4-pyridinyl)thiophen-2-yl]-3-(5-pyrazin-2-yl-2-pyridinyl)propan-2-one (PubChem CID 159619002) has the molecular formula C152H134N40O7S and a molecular weight of 2665.08 g/mol. Its IUPAC name is 1-[2,5-dimethyl-4-(2-methyl-4-pyridinyl)imidazol-1-yl]-3-(5-pyrazin-2-yl-2-pyridinyl)propan-2-one;1-[2-methyl-4-(2-methyl-4-pyridinyl)imidazol-1-yl]-3-(5-pyrazin-2-yl-2-pyridinyl)propan-2-one;1-[5-methyl-4-(2-methyl-4-pyridinyl)imidazol-1-yl]-3-(5-pyrazin-2-yl-2-pyridinyl)propan-2-one;1-[4-(2-methyl-4-pyridinyl)imidazol-1-yl]-3-(5-pyrazin-2-yl-2-pyridinyl)propan-2-one;1-[4-(2-methyl-4-pyridinyl)pyrazol-1-yl]-3-(5-pyrazin-2-yl-2-pyridinyl)propan-2-one;1-[4-(6-methyl-3-pyridinyl)pyrazol-1-yl]-3-(5-pyrazin-2-yl-2-pyridinyl)propan-2-one;1-[5-(2-methyl-4-pyridinyl)thiophen-2-yl]-3-(5-pyrazin-2-yl-2-pyridinyl)propan-2-one.
| Compound Name | 1-[2,5-dimethyl-4-(2-methyl-4-pyridinyl)imidazol-1-yl]-3-(5-pyrazin-2-yl-2-pyridinyl)propan-2-one;1-[2-methyl-4-(2-methyl-4-pyridinyl)imidazol-1-yl]-3-(5-pyrazin-2-yl-2-pyridinyl)propan-2-one;1-[5-methyl-4-(2-methyl-4-pyridinyl)imidazol-1-yl]-3-(5-pyrazin-2-yl-2-pyridinyl)propan-2-one;1-[4-(2-methyl-4-pyridinyl)imidazol-1-yl]-3-(5-pyrazin-2-yl-2-pyridinyl)propan-2-one;1-[4-(2-methyl-4-pyridinyl)pyrazol-1-yl]-3-(5-pyrazin-2-yl-2-pyridinyl)propan-2-one;1-[4-(6-methyl-3-pyridinyl)pyrazol-1-yl]-3-(5-pyrazin-2-yl-2-pyridinyl)propan-2-one;1-[5-(2-methyl-4-pyridinyl)thiophen-2-yl]-3-(5-pyrazin-2-yl-2-pyridinyl)propan-2-one |
|---|---|
| PubChem CID | 159619002 |
| Molecular Formula | C152H134N40O7S |
| Molecular Weight | 2665.08 g/mol |
| Exact Mass | 2663.11 |
| IUPAC Name | 1-[2,5-dimethyl-4-(2-methyl-4-pyridinyl)imidazol-1-yl]-3-(5-pyrazin-2-yl-2-pyridinyl)propan-2-one;1-[2-methyl-4-(2-methyl-4-pyridinyl)imidazol-1-yl]-3-(5-pyrazin-2-yl-2-pyridinyl)propan-2-one;1-[5-methyl-4-(2-methyl-4-pyridinyl)imidazol-1-yl]-3-(5-pyrazin-2-yl-2-pyridinyl)propan-2-one;1-[4-(2-methyl-4-pyridinyl)imidazol-1-yl]-3-(5-pyrazin-2-yl-2-pyridinyl)propan-2-one;1-[4-(2-methyl-4-pyridinyl)pyrazol-1-yl]-3-(5-pyrazin-2-yl-2-pyridinyl)propan-2-one;1-[4-(6-methyl-3-pyridinyl)pyrazol-1-yl]-3-(5-pyrazin-2-yl-2-pyridinyl)propan-2-one;1-[5-(2-methyl-4-pyridinyl)thiophen-2-yl]-3-(5-pyrazin-2-yl-2-pyridinyl)propan-2-one |
| SMILES | Cc1cc(-c2ccc(CC(=O)Cc3ccc(-c4cnccn4)cn3)s2)ccn1.Cc1cc(-c2cn(CC(=O)Cc3ccc(-c4cnccn4)cn3)c(C)n2)ccn1.Cc1cc(-c2cn(CC(=O)Cc3ccc(-c4cnccn4)cn3)cn2)ccn1.Cc1cc(-c2cnn(CC(=O)Cc3ccc(-c4cnccn4)cn3)c2)ccn1.Cc1cc(-c2nc(C)n(CC(=O)Cc3ccc(-c4cnccn4)cn3)c2C)ccn1.Cc1cc(-c2ncn(CC(=O)Cc3ccc(-c4cnccn4)cn3)c2C)ccn1.Cc1ccc(-c2cnn(CC(=O)Cc3ccc(-c4cnccn4)cn3)c2)cn1 |
| InChI | InChI=1S/C23H22N6O.2C22H20N6O.C22H18N4OS.3C21H18N6O/c1-15-10-18(6-7-25-15)23-16(2)29(17(3)28-23)14-21(30)11-20-5-4-19(12-27-20)22-13-24-8-9-26-22;1-15-9-17(5-6-24-15)22-16(2)28(14-27-22)13-20(29)10-19-4-3-18(11-26-19)21-12-23-7-8-25-21;1-15-9-17(5-6-24-15)22-14-28(16(2)27-22)13-20(29)10-19-4-3-18(11-26-19)21-12-23-7-8-25-21;1-15-10-16(6-7-24-15)22-5-4-20(28-22)12-19(27)11-18-3-2-17(13-26-18)21-14-23-8-9-25-21;1-15-8-16(4-5-23-15)18-11-26-27(13-18)14-20(28)9-19-3-2-17(10-25-19)21-12-22-6-7-24-21;1-15-8-16(4-5-23-15)21-13-27(14-26-21)12-19(28)9-18-3-2-17(10-25-18)20-11-22-6-7-24-20;1-15-2-3-16(9-24-15)18-11-26-27(13-18)14-20(28)8-19-5-4-17(10-25-19)21-12-22-6-7-23-21/h4-10,12-13H,11,14H2,1-3H3;2*3-9,11-12,14H,10,13H2,1-2H3;2-10,13-14H,11-12H2,1H3;2-8,10-13H,9,14H2,1H3;2-8,10-11,13-14H,9,12H2,1H3;2-7,9-13H,8,14H2,1H3 |
| InChIKey | MNQPHTJCRDQQHX-UHFFFAOYSA-N |
| XLogP | 23.06 |
| TPSA | 587.33 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 48 |
| Rotatable Bonds | 42 |
| Heavy Atoms | 200 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2665.08 |
| LogP ≤ 5 | 23.06 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 48 |