C156H135Cl5F2N24O13 — CID 158845975
N-(2-chlorophenyl)-2-[1-[2-fluoro-3-[2-(6-methyl-3-pyridinyl)acetyl]phenyl]pyrazol-4-yl]acetamide;N-(2-chlorophenyl)-2-[1-[3-fluoro-5-[2-(6-methyl-3-pyridinyl)acetyl]phenyl]pyrazol-4-yl]acetamide;N-(2-chlorophenyl)-N-(2-hydroxyethyl)-2-[1-[3-[2-(6-methyl-3-pyridinyl)acetyl]phenyl]pyrazol-4-yl]acetamide;N-[(2-chlorophenyl)methyl]-2-[1-[3-[2-(6-methyl-3-pyridinyl)acetyl]phenyl]pyrazol-4-yl]acetamide;N-(2-chlorophenyl)-N-methyl-2-[1-[3-[2-(6-methyl-3-pyridinyl)acetyl]phenyl]pyrazol-4-yl]acetamide;1-[3-[4-[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]pyrazol-1-yl]phenyl]-2-(6-methyl-3-pyridinyl)ethanone (PubChem CID 158845975) has the molecular formula C156H135Cl5F2N24O13 and a molecular weight of 2769.21 g/mol. Its IUPAC name is N-(2-chlorophenyl)-2-[1-[2-fluoro-3-[2-(6-methyl-3-pyridinyl)acetyl]phenyl]pyrazol-4-yl]acetamide;N-(2-chlorophenyl)-2-[1-[3-fluoro-5-[2-(6-methyl-3-pyridinyl)acetyl]phenyl]pyrazol-4-yl]acetamide;N-(2-chlorophenyl)-N-(2-hydroxyethyl)-2-[1-[3-[2-(6-methyl-3-pyridinyl)acetyl]phenyl]pyrazol-4-yl]acetamide;N-[(2-chlorophenyl)methyl]-2-[1-[3-[2-(6-methyl-3-pyridinyl)acetyl]phenyl]pyrazol-4-yl]acetamide;N-(2-chlorophenyl)-N-methyl-2-[1-[3-[2-(6-methyl-3-pyridinyl)acetyl]phenyl]pyrazol-4-yl]acetamide;1-[3-[4-[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]pyrazol-1-yl]phenyl]-2-(6-methyl-3-pyridinyl)ethanone.
| Compound Name | N-(2-chlorophenyl)-2-[1-[2-fluoro-3-[2-(6-methyl-3-pyridinyl)acetyl]phenyl]pyrazol-4-yl]acetamide;N-(2-chlorophenyl)-2-[1-[3-fluoro-5-[2-(6-methyl-3-pyridinyl)acetyl]phenyl]pyrazol-4-yl]acetamide;N-(2-chlorophenyl)-N-(2-hydroxyethyl)-2-[1-[3-[2-(6-methyl-3-pyridinyl)acetyl]phenyl]pyrazol-4-yl]acetamide;N-[(2-chlorophenyl)methyl]-2-[1-[3-[2-(6-methyl-3-pyridinyl)acetyl]phenyl]pyrazol-4-yl]acetamide;N-(2-chlorophenyl)-N-methyl-2-[1-[3-[2-(6-methyl-3-pyridinyl)acetyl]phenyl]pyrazol-4-yl]acetamide;1-[3-[4-[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]pyrazol-1-yl]phenyl]-2-(6-methyl-3-pyridinyl)ethanone |
|---|---|
| PubChem CID | 158845975 |
| Molecular Formula | C156H135Cl5F2N24O13 |
| Molecular Weight | 2769.21 g/mol |
| Exact Mass | 2764.91 |
| IUPAC Name | N-(2-chlorophenyl)-2-[1-[2-fluoro-3-[2-(6-methyl-3-pyridinyl)acetyl]phenyl]pyrazol-4-yl]acetamide;N-(2-chlorophenyl)-2-[1-[3-fluoro-5-[2-(6-methyl-3-pyridinyl)acetyl]phenyl]pyrazol-4-yl]acetamide;N-(2-chlorophenyl)-N-(2-hydroxyethyl)-2-[1-[3-[2-(6-methyl-3-pyridinyl)acetyl]phenyl]pyrazol-4-yl]acetamide;N-[(2-chlorophenyl)methyl]-2-[1-[3-[2-(6-methyl-3-pyridinyl)acetyl]phenyl]pyrazol-4-yl]acetamide;N-(2-chlorophenyl)-N-methyl-2-[1-[3-[2-(6-methyl-3-pyridinyl)acetyl]phenyl]pyrazol-4-yl]acetamide;1-[3-[4-[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]pyrazol-1-yl]phenyl]-2-(6-methyl-3-pyridinyl)ethanone |
| SMILES | Cc1ccc(CC(=O)c2cc(F)cc(-n3cc(CC(=O)Nc4ccccc4Cl)cn3)c2)cn1.Cc1ccc(CC(=O)c2cccc(-n3cc(CC(=O)N(C)c4ccccc4Cl)cn3)c2)cn1.Cc1ccc(CC(=O)c2cccc(-n3cc(CC(=O)N(CCO)c4ccccc4Cl)cn3)c2)cn1.Cc1ccc(CC(=O)c2cccc(-n3cc(CC(=O)N4CCc5ccccc54)cn3)c2)cn1.Cc1ccc(CC(=O)c2cccc(-n3cc(CC(=O)NCc4ccccc4Cl)cn3)c2)cn1.Cc1ccc(CC(=O)c2cccc(-n3cc(CC(=O)Nc4ccccc4Cl)cn3)c2F)cn1 |
| InChI | InChI=1S/C27H25ClN4O3.C27H24N4O2.2C26H23ClN4O2.2C25H20ClFN4O2/c1-19-9-10-20(16-29-19)13-26(34)22-5-4-6-23(15-22)32-18-21(17-30-32)14-27(35)31(11-12-33)25-8-3-2-7-24(25)28;1-19-9-10-20(16-28-19)13-26(32)23-6-4-7-24(15-23)31-18-21(17-29-31)14-27(33)30-12-11-22-5-2-3-8-25(22)30;1-18-10-11-19(15-28-18)12-25(32)21-6-5-7-22(14-21)31-17-20(16-29-31)13-26(33)30(2)24-9-4-3-8-23(24)27;1-18-9-10-19(14-28-18)11-25(32)21-6-4-7-23(13-21)31-17-20(15-30-31)12-26(33)29-16-22-5-2-3-8-24(22)27;1-16-9-10-17(13-28-16)11-23(32)19-5-4-8-22(25(19)27)31-15-18(14-29-31)12-24(33)30-21-7-3-2-6-20(21)26;1-16-6-7-17(13-28-16)8-24(32)19-10-20(27)12-21(11-19)31-15-18(14-29-31)9-25(33)30-23-5-3-2-4-22(23)26/h2-10,15-18,33H,11-14H2,1H3;2-10,15-18H,11-14H2,1H3;3-11,14-17H,12-13H2,1-2H3;2-10,13-15,17H,11-12,16H2,1H3,(H,29,33);2-10,13-15H,11-12H2,1H3,(H,30,33);2-7,10-15H,8-9H2,1H3,(H,30,33) |
| InChIKey | IYVJHMSVFYHXCT-UHFFFAOYSA-N |
| XLogP | 27.68 |
| TPSA | 455.14 Ų |
| H-Bond Donors | 4 |
| H-Bond Acceptors | 31 |
| Rotatable Bonds | 44 |
| Heavy Atoms | 200 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2769.21 |
| LogP ≤ 5 | 27.68 |
| H-Bond Donors ≤ 5 | 4 |
| H-Bond Acceptors ≤ 10 | 31 |