2-{4-[4-(benzylamino)phthalazin-1-yl]phenoxy}-1-(piperidin-1-yl)ethan-1-one
Chemical Structure Depiction of
2-{4-[4-(benzylamino)phthalazin-1-yl]phenoxy}-1-(piperidin-1-yl)ethan-1-one
2-{4-[4-(benzylamino)phthalazin-1-yl]phenoxy}-1-(piperidin-1-yl)ethan-1-one
Compound characteristics
| Compound ID: | 5498-2614 |
| Compound Name: | 2-{4-[4-(benzylamino)phthalazin-1-yl]phenoxy}-1-(piperidin-1-yl)ethan-1-one |
| Molecular Weight: | 452.56 |
| Molecular Formula: | C28 H28 N4 O2 |
| Smiles: | C1CCN(CC1)C(COc1ccc(cc1)c1c2ccccc2c(NCc2ccccc2)nn1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0323 |
| logD: | 4.0321 |
| logSw: | -4.1459 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.703 |
| InChI Key: | VQXATMLJHVMOBW-UHFFFAOYSA-N |