2-{3-[(3-cyclopropyl-1,2,4-oxadiazol-5-yl)methyl]-8-methyl-4-oxo-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl}-N-(2,6-dimethylphenyl)acetamide
Chemical Structure Depiction of
2-{3-[(3-cyclopropyl-1,2,4-oxadiazol-5-yl)methyl]-8-methyl-4-oxo-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl}-N-(2,6-dimethylphenyl)acetamide
2-{3-[(3-cyclopropyl-1,2,4-oxadiazol-5-yl)methyl]-8-methyl-4-oxo-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl}-N-(2,6-dimethylphenyl)acetamide
Compound characteristics
| Compound ID: | L690-1011 |
| Compound Name: | 2-{3-[(3-cyclopropyl-1,2,4-oxadiazol-5-yl)methyl]-8-methyl-4-oxo-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl}-N-(2,6-dimethylphenyl)acetamide |
| Molecular Weight: | 482.54 |
| Molecular Formula: | C27 H26 N6 O3 |
| Smiles: | Cc1ccc2c(c1)c1c(C(N(Cc3nc(C4CC4)no3)C=N1)=O)n2CC(Nc1c(C)cccc1C)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2578 |
| logD: | 4.2578 |
| logSw: | -4.3218 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.548 |
| InChI Key: | IZMWRIWHNPOAPB-UHFFFAOYSA-N |