2-{3-[(3-cyclopropyl-1,2,4-oxadiazol-5-yl)methyl]-8-methyl-4-oxo-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl}-N-[(4-methylphenyl)methyl]acetamide
Chemical Structure Depiction of
2-{3-[(3-cyclopropyl-1,2,4-oxadiazol-5-yl)methyl]-8-methyl-4-oxo-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl}-N-[(4-methylphenyl)methyl]acetamide
2-{3-[(3-cyclopropyl-1,2,4-oxadiazol-5-yl)methyl]-8-methyl-4-oxo-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl}-N-[(4-methylphenyl)methyl]acetamide
Compound characteristics
| Compound ID: | L690-0965 |
| Compound Name: | 2-{3-[(3-cyclopropyl-1,2,4-oxadiazol-5-yl)methyl]-8-methyl-4-oxo-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl}-N-[(4-methylphenyl)methyl]acetamide |
| Molecular Weight: | 482.54 |
| Molecular Formula: | C27 H26 N6 O3 |
| Smiles: | Cc1ccc(CNC(Cn2c3C(N(Cc4nc(C5CC5)no4)C=Nc3c3cc(C)ccc23)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.0742 |
| logD: | 4.0742 |
| logSw: | -4.1457 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.266 |
| InChI Key: | IMZUXWAZYZCDGH-UHFFFAOYSA-N |