3-(3,4-dimethoxyphenyl)-7-hydroxy-8-{[4-(2-hydroxyethyl)piperazin-1-yl]methyl}-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3-(3,4-dimethoxyphenyl)-7-hydroxy-8-{[4-(2-hydroxyethyl)piperazin-1-yl]methyl}-2H-1-benzopyran-2-one
3-(3,4-dimethoxyphenyl)-7-hydroxy-8-{[4-(2-hydroxyethyl)piperazin-1-yl]methyl}-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | G786-1953 |
| Compound Name: | 3-(3,4-dimethoxyphenyl)-7-hydroxy-8-{[4-(2-hydroxyethyl)piperazin-1-yl]methyl}-2H-1-benzopyran-2-one |
| Molecular Weight: | 440.5 |
| Molecular Formula: | C24 H28 N2 O6 |
| Smiles: | COc1ccc(cc1OC)C1=Cc2ccc(c(CN3CCN(CC3)CCO)c2OC1=O)O |
| Stereo: | ACHIRAL |
| logP: | 1.8969 |
| logD: | 1.6111 |
| logSw: | -2.7932 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.56 |
| InChI Key: | ZWNGWUYEAVLYPK-UHFFFAOYSA-N |