7-hydroxy-4-methyl-8-{[4-(pyridin-2-yl)piperazin-1-yl]methyl}-2H-1-benzopyran-2-one
Chemical Structure Depiction of
7-hydroxy-4-methyl-8-{[4-(pyridin-2-yl)piperazin-1-yl]methyl}-2H-1-benzopyran-2-one
7-hydroxy-4-methyl-8-{[4-(pyridin-2-yl)piperazin-1-yl]methyl}-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | Y043-3539 |
| Compound Name: | 7-hydroxy-4-methyl-8-{[4-(pyridin-2-yl)piperazin-1-yl]methyl}-2H-1-benzopyran-2-one |
| Molecular Weight: | 351.4 |
| Molecular Formula: | C20 H21 N3 O3 |
| Smiles: | CC1=CC(=O)Oc2c1ccc(c2CN1CCN(CC1)c1ccccn1)O |
| Stereo: | ACHIRAL |
| logP: | 2.8742 |
| logD: | 2.849 |
| logSw: | -3.1623 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.382 |
| InChI Key: | LSQXYMSQCKRKFQ-UHFFFAOYSA-N |