2,3-difluoro-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;2,5-difluoro-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;3,5-difluoro-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)furan-2-carboxamide;N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)thiophene-2-carboxamide
C81H55F6N15O11S — CID 158098659
Data last refreshed: (MolForge compound catalog, from PubChem)
About 2,3-difluoro-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;2,5-difluoro-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;3,5-difluoro-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)furan-2-carboxamide;N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)thiophene-2-carboxamide
2,3-difluoro-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;2,5-difluoro-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;3,5-difluoro-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)furan-2-carboxamide;N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)thiophene-2-carboxamide (PubChem CID 158098659) has the molecular formula C81H55F6N15O11S and a molecular weight of 1560.48 g/mol. Its IUPAC name is 2,3-difluoro-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;2,5-difluoro-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;3,5-difluoro-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)furan-2-carboxamide;N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)thiophene-2-carboxamide.
Molecular Properties
| Compound Name | 2,3-difluoro-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;2,5-difluoro-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;3,5-difluoro-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)furan-2-carboxamide;N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)thiophene-2-carboxamide |
|---|---|
| PubChem CID | 158098659 |
| Molecular Formula | C81H55F6N15O11S |
| Molecular Weight | 1560.48 g/mol |
| Exact Mass | 1559.38 |
| IUPAC Name | 2,3-difluoro-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;2,5-difluoro-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;3,5-difluoro-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)furan-2-carboxamide;N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)thiophene-2-carboxamide |
| SMILES | O=C(Nc1cc(-c2ccncc2)c[nH]c1=O)c1cc(F)cc(F)c1.O=C(Nc1cc(-c2ccncc2)c[nH]c1=O)c1cc(F)ccc1F.O=C(Nc1cc(-c2ccncc2)c[nH]c1=O)c1cccc(F)c1F.O=C(Nc1cc(-c2ccncc2)c[nH]c1=O)c1ccco1.O=C(Nc1cc(-c2ccncc2)c[nH]c1=O)c1cccs1 |
| InChI | InChI=1S/3C17H11F2N3O2.C15H11N3O3.C15H11N3O2S/c18-13-5-11(6-14(19)8-13)16(23)22-15-7-12(9-21-17(15)24)10-1-3-20-4-2-10;18-12-1-2-14(19)13(8-12)16(23)22-15-7-11(9-21-17(15)24)10-3-5-20-6-4-10;18-13-3-1-2-12(15(13)19)16(23)22-14-8-11(9-21-17(14)24)10-4-6-20-7-5-10;2*19-14-12(18-15(20)13-2-1-7-21-13)8-11(9-17-14)10-3-5-16-6-4-10/h3*1-9H,(H,21,24)(H,22,23);2*1-9H,(H,17,19)(H,18,20) |
| InChIKey | FOZBUCUGYRHQDI-UHFFFAOYSA-N |
| XLogP | 13.94 |
| TPSA | 387.39 Ų |
| H-Bond Donors | 10 |
| H-Bond Acceptors | 17 |
| Rotatable Bonds | 15 |
| Heavy Atoms | 114 |
| Complexity | — |
Lipinski Rule of Five
4 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 1560.48 |
| LogP ≤ 5 | 13.94 |
| H-Bond Donors ≤ 5 | 10 |
| H-Bond Acceptors ≤ 10 | 17 |
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Sources
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