N-[3-(4-benzylpiperidin-1-yl)propyl]-4-(6-chloro-2-methyl-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-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-4-oxobutanamide
N-[3-(4-benzylpiperidin-1-yl)propyl]-4-(6-chloro-2-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-4-oxobutanamide
Compound characteristics
| Compound ID: | E015-0543 |
| Compound Name: | N-[3-(4-benzylpiperidin-1-yl)propyl]-4-(6-chloro-2-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-4-oxobutanamide |
| Molecular Weight: | 498.07 |
| Molecular Formula: | C28 H36 Cl N3 O3 |
| Smiles: | CC1CN(C(CCC(NCCCN2CCC(CC2)Cc2ccccc2)=O)=O)c2cc(ccc2O1)[Cl] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.25 |
| logD: | 2.1578 |
| logSw: | -4.3864 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.096 |
| InChI Key: | QRFXWUZQZNSJDZ-OAQYLSRUSA-N |