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}-N-(3-ethylphenyl)acetamide
Chemical Structure Depiction of
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}-N-(3-ethylphenyl)acetamide
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}-N-(3-ethylphenyl)acetamide
Compound characteristics
| Compound ID: | L690-1235 |
| Compound Name: | 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}-N-(3-ethylphenyl)acetamide |
| Molecular Weight: | 486.53 |
| Molecular Formula: | C26 H26 N6 O4 |
| Smiles: | CCc1cccc(c1)NC(Cn1c2C(N(Cc3nc(CC)no3)C=Nc2c2cc(ccc12)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0724 |
| logD: | 4.0724 |
| logSw: | -4.1834 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 88.227 |
| InChI Key: | NYYBENSPLVHYJG-UHFFFAOYSA-N |