2-[4-(azepan-1-yl)-1-oxophthalazin-2(1H)-yl]-N-(3,5-dimethoxyphenyl)acetamide
Chemical Structure Depiction of
2-[4-(azepan-1-yl)-1-oxophthalazin-2(1H)-yl]-N-(3,5-dimethoxyphenyl)acetamide
2-[4-(azepan-1-yl)-1-oxophthalazin-2(1H)-yl]-N-(3,5-dimethoxyphenyl)acetamide
Compound characteristics
| Compound ID: | M183-0732 |
| Compound Name: | 2-[4-(azepan-1-yl)-1-oxophthalazin-2(1H)-yl]-N-(3,5-dimethoxyphenyl)acetamide |
| Molecular Weight: | 436.51 |
| Molecular Formula: | C24 H28 N4 O4 |
| Smiles: | COc1cc(cc(c1)OC)NC(CN1C(c2ccccc2C(=N1)N1CCCCCC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7477 |
| logD: | 3.7477 |
| logSw: | -3.8441 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.805 |
| InChI Key: | VWGARZRQLIUWDS-UHFFFAOYSA-N |