6-hydroxy-4-{[4-(2-hydroxyethyl)piperazin-1-yl]methyl}-7-methyl-2H-1-benzopyran-2-one
Chemical Structure Depiction of
6-hydroxy-4-{[4-(2-hydroxyethyl)piperazin-1-yl]methyl}-7-methyl-2H-1-benzopyran-2-one
6-hydroxy-4-{[4-(2-hydroxyethyl)piperazin-1-yl]methyl}-7-methyl-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | Y041-3833 |
| Compound Name: | 6-hydroxy-4-{[4-(2-hydroxyethyl)piperazin-1-yl]methyl}-7-methyl-2H-1-benzopyran-2-one |
| Molecular Weight: | 318.37 |
| Molecular Formula: | C17 H22 N2 O4 |
| Smiles: | Cc1cc2c(cc1O)C(CN1CCN(CC1)CCO)=CC(=O)O2 |
| Stereo: | ACHIRAL |
| logP: | 0.533 |
| logD: | 0.0375 |
| logSw: | -1.4461 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 61.372 |
| InChI Key: | TXVDCUNEUJXKNW-UHFFFAOYSA-N |