N-(3-acetylphenyl)-2-[4-(azepan-1-yl)-1-oxophthalazin-2(1H)-yl]acetamide
Chemical Structure Depiction of
N-(3-acetylphenyl)-2-[4-(azepan-1-yl)-1-oxophthalazin-2(1H)-yl]acetamide
N-(3-acetylphenyl)-2-[4-(azepan-1-yl)-1-oxophthalazin-2(1H)-yl]acetamide
Compound characteristics
| Compound ID: | M183-0747 |
| Compound Name: | N-(3-acetylphenyl)-2-[4-(azepan-1-yl)-1-oxophthalazin-2(1H)-yl]acetamide |
| Molecular Weight: | 418.49 |
| Molecular Formula: | C24 H26 N4 O3 |
| Smiles: | CC(c1cccc(c1)NC(CN1C(c2ccccc2C(=N1)N1CCCCCC1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3496 |
| logD: | 3.3495 |
| logSw: | -3.6001 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.544 |
| InChI Key: | CFZDRQGHUJCRIX-UHFFFAOYSA-N |