N-[3-(2,6-dimethylpiperidin-1-yl)propyl]-4-[(E)-{4-[(3-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-ylidene}methyl]benzamide
Chemical Structure Depiction of
N-[3-(2,6-dimethylpiperidin-1-yl)propyl]-4-[(E)-{4-[(3-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-ylidene}methyl]benzamide
N-[3-(2,6-dimethylpiperidin-1-yl)propyl]-4-[(E)-{4-[(3-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-ylidene}methyl]benzamide
Compound characteristics
| Compound ID: | C700-0744 |
| Compound Name: | N-[3-(2,6-dimethylpiperidin-1-yl)propyl]-4-[(E)-{4-[(3-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-ylidene}methyl]benzamide |
| Molecular Weight: | 537.7 |
| Molecular Formula: | C34 H39 N3 O3 |
| Smiles: | CC1CCCC(C)N1CCCNC(c1ccc(\C=C2/C(N(Cc3cccc(C)c3)c3ccccc3O2)=O)cc1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 6.0689 |
| logD: | 2.9681 |
| logSw: | -5.4023 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.825 |
| InChI Key: | VQVDDNZEEQLZSR-UHFFFAOYSA-N |