7-hydroxy-3-(4-methoxyphenyl)-8-{[(2S)-2-(pyridin-3-yl)piperidin-1-yl]methyl}-2H-1-benzopyran-2-one
Chemical Structure Depiction of
7-hydroxy-3-(4-methoxyphenyl)-8-{[(2S)-2-(pyridin-3-yl)piperidin-1-yl]methyl}-2H-1-benzopyran-2-one
7-hydroxy-3-(4-methoxyphenyl)-8-{[(2S)-2-(pyridin-3-yl)piperidin-1-yl]methyl}-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | Y040-5437 |
| Compound Name: | 7-hydroxy-3-(4-methoxyphenyl)-8-{[(2S)-2-(pyridin-3-yl)piperidin-1-yl]methyl}-2H-1-benzopyran-2-one |
| Molecular Weight: | 442.51 |
| Molecular Formula: | C27 H26 N2 O4 |
| Smiles: | COc1ccc(cc1)C1=Cc2ccc(c(CN3CCCC[C@H]3c3cccnc3)c2OC1=O)O |
| Stereo: | ABSOLUTE |
| logP: | 4.1595 |
| logD: | 4.1301 |
| logSw: | -3.713 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.503 |
| InChI Key: | IJXJLSYYFJGVIV-DEOSSOPVSA-N |