2-[4-(azepan-1-yl)-1-oxophthalazin-2(1H)-yl]-N-(2-ethyl-6-methylphenyl)acetamide
Chemical Structure Depiction of
2-[4-(azepan-1-yl)-1-oxophthalazin-2(1H)-yl]-N-(2-ethyl-6-methylphenyl)acetamide
2-[4-(azepan-1-yl)-1-oxophthalazin-2(1H)-yl]-N-(2-ethyl-6-methylphenyl)acetamide
Compound characteristics
| Compound ID: | M183-0838 |
| Compound Name: | 2-[4-(azepan-1-yl)-1-oxophthalazin-2(1H)-yl]-N-(2-ethyl-6-methylphenyl)acetamide |
| Molecular Weight: | 418.54 |
| Molecular Formula: | C25 H30 N4 O2 |
| Smiles: | CCc1cccc(C)c1NC(CN1C(c2ccccc2C(=N1)N1CCCCCC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2774 |
| logD: | 4.2774 |
| logSw: | -4.1186 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.322 |
| InChI Key: | CGEOVZHZVKPFAI-UHFFFAOYSA-N |