4-({4-[(4-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-ylidene}methyl)-N-[3-(3-methylpiperidin-1-yl)propyl]benzamide
Chemical Structure Depiction of
4-({4-[(4-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-ylidene}methyl)-N-[3-(3-methylpiperidin-1-yl)propyl]benzamide
4-({4-[(4-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-ylidene}methyl)-N-[3-(3-methylpiperidin-1-yl)propyl]benzamide
Compound characteristics
| Compound ID: | K788-5724 |
| Compound Name: | 4-({4-[(4-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-ylidene}methyl)-N-[3-(3-methylpiperidin-1-yl)propyl]benzamide |
| Molecular Weight: | 523.68 |
| Molecular Formula: | C33 H37 N3 O3 |
| Smiles: | CC1CCCN(CCCNC(c2ccc(\C=C3/C(N(Cc4ccc(C)cc4)c4ccccc4O3)=O)cc2)=O)C1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.5244 |
| logD: | 2.9529 |
| logSw: | -5.3471 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.203 |
| InChI Key: | JXLHZJOGWODNPD-VWLOTQADSA-N |