2-[1'-(1-methyl-1H-imidazole-5-carbonyl)-3,4-dihydrospiro[[2]benzopyran-1,4'-piperidin]-3-yl]-N-[(1-methyl-1H-pyrazol-4-yl)methyl]acetamide
Chemical Structure Depiction of
2-[1'-(1-methyl-1H-imidazole-5-carbonyl)-3,4-dihydrospiro[[2]benzopyran-1,4'-piperidin]-3-yl]-N-[(1-methyl-1H-pyrazol-4-yl)methyl]acetamide
2-[1'-(1-methyl-1H-imidazole-5-carbonyl)-3,4-dihydrospiro[[2]benzopyran-1,4'-piperidin]-3-yl]-N-[(1-methyl-1H-pyrazol-4-yl)methyl]acetamide
Compound characteristics
| Compound ID: | SA90-0247 |
| Compound Name: | 2-[1'-(1-methyl-1H-imidazole-5-carbonyl)-3,4-dihydrospiro[[2]benzopyran-1,4'-piperidin]-3-yl]-N-[(1-methyl-1H-pyrazol-4-yl)methyl]acetamide |
| Molecular Weight: | 462.55 |
| Molecular Formula: | C25 H30 N6 O3 |
| Smiles: | Cn1cncc1C(N1CCC2(CC1)c1ccccc1CC(CC(NCc1cnn(C)c1)=O)O2)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.4462 |
| logD: | 0.4099 |
| logSw: | -1.7893 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.446 |
| InChI Key: | PECCQOLUQQJMNG-HXUWFJFHSA-N |