2-{3-[(3-tert-butyl-1,2,4-oxadiazol-5-yl)methyl]-8-methyl-4-oxo-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl}-N-(3-fluorophenyl)acetamide
Chemical Structure Depiction of
2-{3-[(3-tert-butyl-1,2,4-oxadiazol-5-yl)methyl]-8-methyl-4-oxo-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl}-N-(3-fluorophenyl)acetamide
2-{3-[(3-tert-butyl-1,2,4-oxadiazol-5-yl)methyl]-8-methyl-4-oxo-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl}-N-(3-fluorophenyl)acetamide
Compound characteristics
| Compound ID: | L690-1083 |
| Compound Name: | 2-{3-[(3-tert-butyl-1,2,4-oxadiazol-5-yl)methyl]-8-methyl-4-oxo-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl}-N-(3-fluorophenyl)acetamide |
| Molecular Weight: | 488.52 |
| Molecular Formula: | C26 H25 F N6 O3 |
| Smiles: | Cc1ccc2c(c1)c1c(C(N(Cc3nc(C(C)(C)C)no3)C=N1)=O)n2CC(Nc1cccc(c1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8594 |
| logD: | 4.859 |
| logSw: | -4.7601 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.692 |
| InChI Key: | RMRKVMWPNXHVOW-UHFFFAOYSA-N |