N-[3-(4-benzylpiperidin-1-yl)propyl]-4-(6-chloro-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-4-oxobutanamide
Chemical Structure Depiction of
N-[3-(4-benzylpiperidin-1-yl)propyl]-4-(6-chloro-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-4-oxobutanamide
N-[3-(4-benzylpiperidin-1-yl)propyl]-4-(6-chloro-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-4-oxobutanamide
Compound characteristics
| Compound ID: | E015-0239 |
| Compound Name: | N-[3-(4-benzylpiperidin-1-yl)propyl]-4-(6-chloro-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-4-oxobutanamide |
| Molecular Weight: | 484.04 |
| Molecular Formula: | C27 H34 Cl N3 O3 |
| Smiles: | C(CNC(CCC(N1CCOc2ccc(cc12)[Cl])=O)=O)CN1CCC(CC1)Cc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 3.8515 |
| logD: | 1.7594 |
| logSw: | -4.3133 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.999 |
| InChI Key: | KQWMLSKVICKNJX-UHFFFAOYSA-N |