N-(2,3-dimethylphenyl)-2-{3-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl]-8-methoxy-4-oxo-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl}acetamide
Chemical Structure Depiction of
N-(2,3-dimethylphenyl)-2-{3-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl]-8-methoxy-4-oxo-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl}acetamide
N-(2,3-dimethylphenyl)-2-{3-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl]-8-methoxy-4-oxo-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl}acetamide
Compound characteristics
Compound ID: | L690-1240 |
Compound Name: | N-(2,3-dimethylphenyl)-2-{3-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl]-8-methoxy-4-oxo-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl}acetamide |
Molecular Weight: | 486.53 |
Molecular Formula: | C26 H26 N6 O4 |
Smiles: | CCc1nc(CN2C=Nc3c4cc(ccc4n(CC(Nc4cccc(C)c4C)=O)c3C2=O)OC)on1 |
Stereo: | ACHIRAL |
logP: | 3.9124 |
logD: | 3.9124 |
logSw: | -4.0632 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 87.529 |
InChI Key: | QOXFHEFXKOAYMU-UHFFFAOYSA-N |