2-{3-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl]-4-oxo-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl}-N-[(3-methoxyphenyl)methyl]acetamide
Chemical Structure Depiction of
2-{3-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl]-4-oxo-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl}-N-[(3-methoxyphenyl)methyl]acetamide
2-{3-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl]-4-oxo-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl}-N-[(3-methoxyphenyl)methyl]acetamide
Compound characteristics
| Compound ID: | L690-0268 |
| Compound Name: | 2-{3-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl]-4-oxo-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl}-N-[(3-methoxyphenyl)methyl]acetamide |
| Molecular Weight: | 472.5 |
| Molecular Formula: | C25 H24 N6 O4 |
| Smiles: | [H]c1ccc2c(c1)c1c(C(N(Cc3nc(CC)no3)C=N1)=O)n2CC(NCc1cccc(c1)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8169 |
| logD: | 2.8169 |
| logSw: | -3.2712 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 89.549 |
| InChI Key: | LEDCQBUNSDOWKL-UHFFFAOYSA-N |