3-(2,3-dihydro-1,4-benzodioxin-6-yl)-8-[(4-ethylpiperazin-1-yl)methyl]-7-hydroxy-4H-1-benzopyran-4-one
Chemical Structure Depiction of
3-(2,3-dihydro-1,4-benzodioxin-6-yl)-8-[(4-ethylpiperazin-1-yl)methyl]-7-hydroxy-4H-1-benzopyran-4-one
3-(2,3-dihydro-1,4-benzodioxin-6-yl)-8-[(4-ethylpiperazin-1-yl)methyl]-7-hydroxy-4H-1-benzopyran-4-one
Compound characteristics
| Compound ID: | Y041-2706 |
| Compound Name: | 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-8-[(4-ethylpiperazin-1-yl)methyl]-7-hydroxy-4H-1-benzopyran-4-one |
| Molecular Weight: | 422.48 |
| Molecular Formula: | C24 H26 N2 O5 |
| Smiles: | CCN1CCN(CC1)Cc1c(ccc2C(C(=COc12)c1ccc2c(c1)OCCO2)=O)O |
| Stereo: | ACHIRAL |
| logP: | 1.8023 |
| logD: | 0.8706 |
| logSw: | -2.8577 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.185 |
| InChI Key: | GPUCVLWFGMXDQH-UHFFFAOYSA-N |