2-{8-fluoro-4-oxo-3-[(3-propyl-1,2,4-oxadiazol-5-yl)methyl]-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl}-N-[(4-methylphenyl)methyl]acetamide
Chemical Structure Depiction of
2-{8-fluoro-4-oxo-3-[(3-propyl-1,2,4-oxadiazol-5-yl)methyl]-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl}-N-[(4-methylphenyl)methyl]acetamide
2-{8-fluoro-4-oxo-3-[(3-propyl-1,2,4-oxadiazol-5-yl)methyl]-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl}-N-[(4-methylphenyl)methyl]acetamide
Compound characteristics
| Compound ID: | L690-1480 |
| Compound Name: | 2-{8-fluoro-4-oxo-3-[(3-propyl-1,2,4-oxadiazol-5-yl)methyl]-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl}-N-[(4-methylphenyl)methyl]acetamide |
| Molecular Weight: | 488.52 |
| Molecular Formula: | C26 H25 F N6 O3 |
| Smiles: | CCCc1nc(CN2C=Nc3c4cc(ccc4n(CC(NCc4ccc(C)cc4)=O)c3C2=O)F)on1 |
| Stereo: | ACHIRAL |
| logP: | 3.8707 |
| logD: | 3.8707 |
| logSw: | -3.9217 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.005 |
| InChI Key: | HDJAAKXGOPKNDZ-UHFFFAOYSA-N |