N-(3,5-dimethylphenyl)-2-(4-oxo-3-{[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]methyl}-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl)acetamide
Chemical Structure Depiction of
N-(3,5-dimethylphenyl)-2-(4-oxo-3-{[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]methyl}-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl)acetamide
N-(3,5-dimethylphenyl)-2-(4-oxo-3-{[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]methyl}-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl)acetamide
Compound characteristics
| Compound ID: | L690-1642 |
| Compound Name: | N-(3,5-dimethylphenyl)-2-(4-oxo-3-{[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]methyl}-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl)acetamide |
| Molecular Weight: | 470.53 |
| Molecular Formula: | C26 H26 N6 O3 |
| Smiles: | CC(C)c1nc(CN2C=Nc3c4ccccc4n(CC(Nc4cc(C)cc(C)c4)=O)c3C2=O)on1 |
| Stereo: | ACHIRAL |
| logP: | 4.3473 |
| logD: | 4.3473 |
| logSw: | -4.3891 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.692 |
| InChI Key: | JQQQPBDBOGQTBA-UHFFFAOYSA-N |