N-(4-ethylphenyl)-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-(4-ethylphenyl)-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-(4-ethylphenyl)-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: | L690-1589 |
Compound Name: | N-(4-ethylphenyl)-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: | CCc1ccc(cc1)NC(Cn1c2C(N(Cc3nc(C(C)C)no3)C=Nc2c2ccccc12)=O)=O |
Stereo: | ACHIRAL |
logP: | 4.585 |
logD: | 4.585 |
logSw: | -4.2493 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 79.692 |
InChI Key: | KWENPQXPAXDAEL-UHFFFAOYSA-N |