2-{3-[(3-cyclopropyl-1,2,4-oxadiazol-5-yl)methyl]-4-oxo-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl}-N-(2,3-dimethylphenyl)acetamide
Chemical Structure Depiction of
2-{3-[(3-cyclopropyl-1,2,4-oxadiazol-5-yl)methyl]-4-oxo-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl}-N-(2,3-dimethylphenyl)acetamide
2-{3-[(3-cyclopropyl-1,2,4-oxadiazol-5-yl)methyl]-4-oxo-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl}-N-(2,3-dimethylphenyl)acetamide
Compound characteristics
| Compound ID: | L690-0547 |
| Compound Name: | 2-{3-[(3-cyclopropyl-1,2,4-oxadiazol-5-yl)methyl]-4-oxo-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl}-N-(2,3-dimethylphenyl)acetamide |
| Molecular Weight: | 468.51 |
| Molecular Formula: | C26 H24 N6 O3 |
| Smiles: | [H]c1ccc2c(c1)c1c(C(N(Cc3nc(C4CC4)no3)C=N1)=O)n2CC(Nc1cccc(C)c1C)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1339 |
| logD: | 4.1339 |
| logSw: | -4.2311 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.246 |
| InChI Key: | QHAVUBRQGUOYIV-UHFFFAOYSA-N |