2-[4-(azepan-1-yl)-1-oxophthalazin-2(1H)-yl]-N-(2,3-dimethylphenyl)acetamide
Chemical Structure Depiction of
2-[4-(azepan-1-yl)-1-oxophthalazin-2(1H)-yl]-N-(2,3-dimethylphenyl)acetamide
2-[4-(azepan-1-yl)-1-oxophthalazin-2(1H)-yl]-N-(2,3-dimethylphenyl)acetamide
Compound characteristics
| Compound ID: | M183-0842 |
| Compound Name: | 2-[4-(azepan-1-yl)-1-oxophthalazin-2(1H)-yl]-N-(2,3-dimethylphenyl)acetamide |
| Molecular Weight: | 404.51 |
| Molecular Formula: | C24 H28 N4 O2 |
| Smiles: | Cc1cccc(c1C)NC(CN1C(c2ccccc2C(=N1)N1CCCCCC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2392 |
| logD: | 4.2392 |
| logSw: | -4.1539 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.02 |
| InChI Key: | WWHGJOBFJFLLBA-UHFFFAOYSA-N |