2-{8-methyl-3-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-4-oxo-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl}-N-(4-methylphenyl)acetamide
Chemical Structure Depiction of
2-{8-methyl-3-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-4-oxo-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl}-N-(4-methylphenyl)acetamide
2-{8-methyl-3-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-4-oxo-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl}-N-(4-methylphenyl)acetamide
Compound characteristics
| Compound ID: | L690-0599 |
| Compound Name: | 2-{8-methyl-3-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-4-oxo-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl}-N-(4-methylphenyl)acetamide |
| Molecular Weight: | 442.48 |
| Molecular Formula: | C24 H22 N6 O3 |
| Smiles: | Cc1ccc(cc1)NC(Cn1c2C(N(Cc3nc(C)no3)C=Nc2c2cc(C)ccc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.479 |
| logD: | 3.479 |
| logSw: | -3.7346 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.305 |
| InChI Key: | XITAIPDPFMDWTC-UHFFFAOYSA-N |