2-{3-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl]-8-fluoro-4-oxo-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl}-N-[(furan-2-yl)methyl]acetamide
Chemical Structure Depiction of
2-{3-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl]-8-fluoro-4-oxo-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl}-N-[(furan-2-yl)methyl]acetamide
2-{3-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl]-8-fluoro-4-oxo-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl}-N-[(furan-2-yl)methyl]acetamide
Compound characteristics
| Compound ID: | L690-1404 |
| Compound Name: | 2-{3-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl]-8-fluoro-4-oxo-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl}-N-[(furan-2-yl)methyl]acetamide |
| Molecular Weight: | 450.43 |
| Molecular Formula: | C22 H19 F N6 O4 |
| Smiles: | CCc1nc(CN2C=Nc3c4cc(ccc4n(CC(NCc4ccco4)=O)c3C2=O)F)on1 |
| Stereo: | ACHIRAL |
| logP: | 2.6506 |
| logD: | 2.6506 |
| logSw: | -2.8379 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 89.754 |
| InChI Key: | XLSPFDUQIQLZBJ-UHFFFAOYSA-N |