2-[4-(azepan-1-yl)-1-oxophthalazin-2(1H)-yl]-N-(3-methylphenyl)acetamide
Chemical Structure Depiction of
2-[4-(azepan-1-yl)-1-oxophthalazin-2(1H)-yl]-N-(3-methylphenyl)acetamide
2-[4-(azepan-1-yl)-1-oxophthalazin-2(1H)-yl]-N-(3-methylphenyl)acetamide
Compound characteristics
| Compound ID: | M183-0822 |
| Compound Name: | 2-[4-(azepan-1-yl)-1-oxophthalazin-2(1H)-yl]-N-(3-methylphenyl)acetamide |
| Molecular Weight: | 390.48 |
| Molecular Formula: | C23 H26 N4 O2 |
| Smiles: | Cc1cccc(c1)NC(CN1C(c2ccccc2C(=N1)N1CCCCCC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9686 |
| logD: | 3.9686 |
| logSw: | -3.9764 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.717 |
| InChI Key: | XXIGUKIJQYWBGF-UHFFFAOYSA-N |